data_c25525_2n0h ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c25525_2n0h _Entry.Title ; NMR structure of Neuromedin C in presence of SDS micelles ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-03-05 _Entry.Accession_date 2015-03-05 _Entry.Last_release_date 2015-10-12 _Entry.Original_release_date 2015-10-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'Solution structure of Neuromedin C embedded into SDS micelles.' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Miquel Adrover . . . c25525_2n0h 2 Pilar Sanchis . . . c25525_2n0h 3 Bartolome Vilanova . . . c25525_2n0h 4 Kris Pauwels . . . c25525_2n0h 5 Gabriel Martorell . . . c25525_2n0h 6 'Juan Jesus' Perez . . . c25525_2n0h stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . c25525_2n0h stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Feeding regulation' . c25525_2n0h 'Growth and differentiation of human tumors' . c25525_2n0h Neuropeptide . c25525_2n0h stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c25525_2n0h heteronucl_NOEs 1 c25525_2n0h heteronucl_T1_relaxation 1 c25525_2n0h heteronucl_T2_relaxation 1 c25525_2n0h stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 34 c25525_2n0h '15N chemical shifts' 12 c25525_2n0h '1H chemical shifts' 69 c25525_2n0h 'chemical shifts' 10 c25525_2n0h stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2015-10-12 . original BMRB . c25525_2n0h stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25519 'Neuromedin C in aqueous solution' c25525_2n0h BMRB 25520 'Neuromedin C in 10% TFE' c25525_2n0h BMRB 25521 'Neuromedin C in 25% TFE' c25525_2n0h BMRB 25522 'Neuromedin C in 40% TFE' c25525_2n0h BMRB 25523 'Neuromedin C in 60% TFE' c25525_2n0h BMRB 25524 'Neuromedin C in 90% TFE' c25525_2n0h PDB 1C98 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25525_2n0h PDB 1C9A 'SOLUTION STRUCTURE OF NEUROMEDIN B' c25525_2n0h PDB 2N0H 'BMRB Entry Tracking System' c25525_2n0h stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c25525_2n0h _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Conformational ensembles of neuromedin C reveal a progressive coil-helix transition within a binding-induced folding mechanism ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'RSC ADV' _Citation.Journal_name_full . _Citation.Journal_volume 5 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 83074 _Citation.Page_last 83088 _Citation.Year 2015 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Miquel Adrover . . . c25525_2n0h 1 2 Pilar Sanchis . . . c25525_2n0h 1 3 Bartolome Vilanova . . . c25525_2n0h 1 4 Kris Pauwels . . . c25525_2n0h 1 5 Gabriel Martorell . . . c25525_2n0h 1 6 J. Perez . . . c25525_2n0h 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c25525_2n0h _Assembly.ID 1 _Assembly.Name 'Neuromedin C in presence of SDS micelles' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity 1 $entity A . yes native no no . . . c25525_2n0h 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2n0h . . 'solution NMR' . . . c25525_2n0h 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID c25525_2n0h _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Neuromedin_C _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GNHWAVGHLMX ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 11 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1123.295 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes PDB 2n0h . . . . . . . . . . . . . . . . c25525_2n0h 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Elicits gastrin release and regulates gastric acid secretion and enteric motor function.' c25525_2n0h 1 'Mediates on neurotransmission and neuromodulation.' c25525_2n0h 1 'Plays a central role in regulation of the neuroendocrine and autonomic systems' c25525_2n0h 1 'Regulate growth and/or differentiation of different human tumors.' c25525_2n0h 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . c25525_2n0h 1 2 . ASN . c25525_2n0h 1 3 . HIS . c25525_2n0h 1 4 . TRP . c25525_2n0h 1 5 . ALA . c25525_2n0h 1 6 . VAL . c25525_2n0h 1 7 . GLY . c25525_2n0h 1 8 . HIS . c25525_2n0h 1 9 . LEU . c25525_2n0h 1 10 . MET . c25525_2n0h 1 11 . NH2 . c25525_2n0h 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 c25525_2n0h 1 . ASN 2 2 c25525_2n0h 1 . HIS 3 3 c25525_2n0h 1 . TRP 4 4 c25525_2n0h 1 . ALA 5 5 c25525_2n0h 1 . VAL 6 6 c25525_2n0h 1 . GLY 7 7 c25525_2n0h 1 . HIS 8 8 c25525_2n0h 1 . LEU 9 9 c25525_2n0h 1 . MET 10 10 c25525_2n0h 1 . NH2 11 11 c25525_2n0h 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID c25525_2n0h _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . c25525_2n0h 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID c25525_2n0h _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'obtained from a vendor' . . . . . . . . . . . . . . . 'Neuromedin C was purchased from Holzel Diagnostika Handels GmbH' c25525_2n0h 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID c25525_2n0h _Chem_comp.ID NH2 _Chem_comp.Provenance PDB _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code NH2 _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code NH2 _Chem_comp.Number_atoms_all 3 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code InChI=1/H3N/h1H3 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details 'OpenEye OEToolkits' _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/H3N/h1H3 InChI InChI 1.02b c25525_2n0h NH2 N SMILES ACDLabs 10.04 c25525_2n0h NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b c25525_2n0h NH2 [NH2] SMILES CACTVS 3.341 c25525_2n0h NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 c25525_2n0h NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 c25525_2n0h NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 c25525_2n0h NH2 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 c25525_2n0h NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 c25525_2n0h NH2 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N N N N . N . . N 0 . . . 1 no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . c25525_2n0h NH2 HN1 HN1 HN1 1HN . H . . N 0 . . . 1 no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . c25525_2n0h NH2 HN2 HN2 HN2 2HN . H . . N 0 . . . 1 no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . c25525_2n0h NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . c25525_2n0h NH2 2 . SING N HN2 no N 2 . c25525_2n0h NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID c25525_2n0h _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'The sample was prepared in 10mM acetate buffer at pH 4.0 in presence of deuterated SDS micelles.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity 'natural abundance' . . 1 $entity . . 5.0 . . mM 0.1 . . . c25525_2n0h 1 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . c25525_2n0h 1 3 DSS 'natural abundance' . . . . . . 1.6 . . mM 0.1 . . . c25525_2n0h 1 4 SDS '[U-99% 2H]' . . . . . . 150 . . mM 2 . . . c25525_2n0h 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . c25525_2n0h 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . c25525_2n0h 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID c25525_2n0h _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'The sample was prepared in 10mM acetate buffer at pH 4.0 in presence of non-deuterated SDS micelles.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity 'natural abundance' . . 1 $entity . . 5.0 . . mM 0.1 . . . c25525_2n0h 2 2 'sodium acetate' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . c25525_2n0h 2 3 DSS 'natural abundance' . . . . . . 1.6 . . mM 0.1 . . . c25525_2n0h 2 4 SDS 'natural abundance' . . . . . . 50 . . mM 0.5 . . . c25525_2n0h 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . c25525_2n0h 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . c25525_2n0h 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c25525_2n0h _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.01 . M c25525_2n0h 1 pH 4.0 . pH c25525_2n0h 1 pressure 1 . atm c25525_2n0h 1 temperature 273 . K c25525_2n0h 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID c25525_2n0h _Sample_condition_list.ID 2 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.01 . M c25525_2n0h 2 pH 4.0 . pH c25525_2n0h 2 pressure 1 . atm c25525_2n0h 2 temperature 273 . K c25525_2n0h 2 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c25525_2n0h _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c25525_2n0h 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c25525_2n0h 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID c25525_2n0h _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . c25525_2n0h 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c25525_2n0h 2 'peak picking' c25525_2n0h 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID c25525_2n0h _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . c25525_2n0h 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' c25525_2n0h 3 refinement c25525_2n0h 3 'structure solution' c25525_2n0h 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID c25525_2n0h _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c25525_2n0h _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 'Bruker Avance III spectrometer operating at 14.1T (600MHz) and equipped with a 5-mm 13C, 15N, 1H triple resonance cryoprobe.' . . c25525_2n0h 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID c25525_2n0h _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 5 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 6 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 7 '2D 15N-T1' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 8 '2D 15N-T2' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 9 '2D 15N- HET-NOE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . c25525_2n0h 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c25525_2n0h _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25525_2n0h 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . c25525_2n0h 1 N 15 water protons . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . c25525_2n0h 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c25525_2n0h _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . c25525_2n0h 1 3 '2D 1H-15N HSQC' . . . c25525_2n0h 1 4 '2D 1H-13C HSQC' . . . c25525_2n0h 1 5 '2D 1H-13C HSQC aromatic' . . . c25525_2n0h 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $XEASY . . c25525_2n0h 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.982 0.010 . 2 . . . A 1 GLY HA2 . c25525_2n0h 1 2 . 1 1 1 1 GLY HA3 H 1 3.891 0.010 . 2 . . . A 1 GLY HA3 . c25525_2n0h 1 3 . 1 1 1 1 GLY CA C 13 43.675 0.100 . 1 . . . A 1 GLY CA . c25525_2n0h 1 4 . 1 1 2 2 ASN H H 1 8.651 0.012 . 1 . . . A 2 ASN H . c25525_2n0h 1 5 . 1 1 2 2 ASN HA H 1 4.677 0.013 . 1 . . . A 2 ASN HA . c25525_2n0h 1 6 . 1 1 2 2 ASN HB2 H 1 2.696 0.006 . 2 . . . A 2 ASN HB2 . c25525_2n0h 1 7 . 1 1 2 2 ASN HB3 H 1 2.629 0.004 . 2 . . . A 2 ASN HB3 . c25525_2n0h 1 8 . 1 1 2 2 ASN HD21 H 1 7.527 0.011 . 2 . . . A 2 ASN HD21 . c25525_2n0h 1 9 . 1 1 2 2 ASN HD22 H 1 6.887 0.011 . 2 . . . A 2 ASN HD22 . c25525_2n0h 1 10 . 1 1 2 2 ASN CA C 13 53.638 0.100 . 1 . . . A 2 ASN CA . c25525_2n0h 1 11 . 1 1 2 2 ASN CB C 13 38.994 0.100 . 1 . . . A 2 ASN CB . c25525_2n0h 1 12 . 1 1 2 2 ASN N N 15 117.210 0.100 . 1 . . . A 2 ASN N . c25525_2n0h 1 13 . 1 1 2 2 ASN ND2 N 15 112.852 0.100 . 1 . . . A 2 ASN ND2 . c25525_2n0h 1 14 . 1 1 3 3 HIS H H 1 8.572 0.014 . 1 . . . A 3 HIS H . c25525_2n0h 1 15 . 1 1 3 3 HIS HA H 1 4.744 0.007 . 1 . . . A 3 HIS HA . c25525_2n0h 1 16 . 1 1 3 3 HIS HB2 H 1 3.257 0.005 . 2 . . . A 3 HIS HB2 . c25525_2n0h 1 17 . 1 1 3 3 HIS HB3 H 1 3.257 0.005 . 2 . . . A 3 HIS HB3 . c25525_2n0h 1 18 . 1 1 3 3 HIS HD2 H 1 7.282 0.011 . 1 . . . A 3 HIS HD2 . c25525_2n0h 1 19 . 1 1 3 3 HIS HE1 H 1 8.613 0.012 . 1 . . . A 3 HIS HE1 . c25525_2n0h 1 20 . 1 1 3 3 HIS CA C 13 56.023 0.100 . 1 . . . A 3 HIS CA . c25525_2n0h 1 21 . 1 1 3 3 HIS CB C 13 27.771 0.100 . 1 . . . A 3 HIS CB . c25525_2n0h 1 22 . 1 1 3 3 HIS CD2 C 13 120.603 0.100 . 1 . . . A 3 HIS CD2 . c25525_2n0h 1 23 . 1 1 3 3 HIS CE1 C 13 136.701 0.100 . 1 . . . A 3 HIS CE1 . c25525_2n0h 1 24 . 1 1 3 3 HIS N N 15 116.338 0.100 . 1 . . . A 3 HIS N . c25525_2n0h 1 25 . 1 1 4 4 TRP H H 1 8.243 0.007 . 1 . . . A 4 TRP H . c25525_2n0h 1 26 . 1 1 4 4 TRP HA H 1 4.424 0.004 . 1 . . . A 4 TRP HA . c25525_2n0h 1 27 . 1 1 4 4 TRP HB2 H 1 3.337 0.004 . 2 . . . A 4 TRP HB2 . c25525_2n0h 1 28 . 1 1 4 4 TRP HB3 H 1 3.283 0.004 . 2 . . . A 4 TRP HB3 . c25525_2n0h 1 29 . 1 1 4 4 TRP HD1 H 1 7.268 0.003 . 1 . . . A 4 TRP HD1 . c25525_2n0h 1 30 . 1 1 4 4 TRP HE1 H 1 10.040 0.003 . 1 . . . A 4 TRP HE1 . c25525_2n0h 1 31 . 1 1 4 4 TRP HE3 H 1 7.502 0.011 . 1 . . . A 4 TRP HE3 . c25525_2n0h 1 32 . 1 1 4 4 TRP HZ2 H 1 7.421 0.011 . 1 . . . A 4 TRP HZ2 . c25525_2n0h 1 33 . 1 1 4 4 TRP HZ3 H 1 6.977 0.011 . 1 . . . A 4 TRP HZ3 . c25525_2n0h 1 34 . 1 1 4 4 TRP HH2 H 1 7.006 0.010 . 1 . . . A 4 TRP HH2 . c25525_2n0h 1 35 . 1 1 4 4 TRP CA C 13 59.589 0.100 . 1 . . . A 4 TRP CA . c25525_2n0h 1 36 . 1 1 4 4 TRP CB C 13 30.326 0.100 . 1 . . . A 4 TRP CB . c25525_2n0h 1 37 . 1 1 4 4 TRP CD1 C 13 127.174 0.100 . 1 . . . A 4 TRP CD1 . c25525_2n0h 1 38 . 1 1 4 4 TRP CE3 C 13 120.552 0.100 . 1 . . . A 4 TRP CE3 . c25525_2n0h 1 39 . 1 1 4 4 TRP CZ2 C 13 114.552 0.100 . 1 . . . A 4 TRP CZ2 . c25525_2n0h 1 40 . 1 1 4 4 TRP CZ3 C 13 124.046 0.100 . 1 . . . A 4 TRP CZ3 . c25525_2n0h 1 41 . 1 1 4 4 TRP CH2 C 13 121.426 0.100 . 1 . . . A 4 TRP CH2 . c25525_2n0h 1 42 . 1 1 4 4 TRP N N 15 120.903 0.100 . 1 . . . A 4 TRP N . c25525_2n0h 1 43 . 1 1 4 4 TRP NE1 N 15 128.468 0.100 . 1 . . . A 4 TRP NE1 . c25525_2n0h 1 44 . 1 1 5 5 ALA H H 1 8.468 0.012 . 1 . . . A 5 ALA H . c25525_2n0h 1 45 . 1 1 5 5 ALA HA H 1 4.146 0.013 . 1 . . . A 5 ALA HA . c25525_2n0h 1 46 . 1 1 5 5 ALA HB1 H 1 1.388 0.005 . 1 . . . A 5 ALA HB1 . c25525_2n0h 1 47 . 1 1 5 5 ALA HB2 H 1 1.388 0.005 . 1 . . . A 5 ALA HB2 . c25525_2n0h 1 48 . 1 1 5 5 ALA HB3 H 1 1.388 0.005 . 1 . . . A 5 ALA HB3 . c25525_2n0h 1 49 . 1 1 5 5 ALA CA C 13 53.903 0.100 . 1 . . . A 5 ALA CA . c25525_2n0h 1 50 . 1 1 5 5 ALA CB C 13 18.359 0.100 . 1 . . . A 5 ALA CB . c25525_2n0h 1 51 . 1 1 5 5 ALA N N 15 123.802 0.100 . 1 . . . A 5 ALA N . c25525_2n0h 1 52 . 1 1 6 6 VAL H H 1 8.030 0.005 . 1 . . . A 6 VAL H . c25525_2n0h 1 53 . 1 1 6 6 VAL HA H 1 3.753 0.011 . 1 . . . A 6 VAL HA . c25525_2n0h 1 54 . 1 1 6 6 VAL HB H 1 2.045 0.008 . 1 . . . A 6 VAL HB . c25525_2n0h 1 55 . 1 1 6 6 VAL HG11 H 1 1.037 0.011 . 1 . . . A 6 VAL HG11 . c25525_2n0h 1 56 . 1 1 6 6 VAL HG12 H 1 1.037 0.011 . 1 . . . A 6 VAL HG12 . c25525_2n0h 1 57 . 1 1 6 6 VAL HG13 H 1 1.037 0.011 . 1 . . . A 6 VAL HG13 . c25525_2n0h 1 58 . 1 1 6 6 VAL HG21 H 1 0.973 0.006 . 1 . . . A 6 VAL HG21 . c25525_2n0h 1 59 . 1 1 6 6 VAL HG22 H 1 0.973 0.006 . 1 . . . A 6 VAL HG22 . c25525_2n0h 1 60 . 1 1 6 6 VAL HG23 H 1 0.973 0.006 . 1 . . . A 6 VAL HG23 . c25525_2n0h 1 61 . 1 1 6 6 VAL CA C 13 65.042 0.100 . 1 . . . A 6 VAL CA . c25525_2n0h 1 62 . 1 1 6 6 VAL CB C 13 31.879 0.100 . 1 . . . A 6 VAL CB . c25525_2n0h 1 63 . 1 1 6 6 VAL CG1 C 13 22.002 0.100 . 1 . . . A 6 VAL CG1 . c25525_2n0h 1 64 . 1 1 6 6 VAL CG2 C 13 21.432 0.100 . 1 . . . A 6 VAL CG2 . c25525_2n0h 1 65 . 1 1 6 6 VAL N N 15 118.392 0.100 . 1 . . . A 6 VAL N . c25525_2n0h 1 66 . 1 1 7 7 GLY H H 1 8.382 0.012 . 1 . . . A 7 GLY H . c25525_2n0h 1 67 . 1 1 7 7 GLY HA2 H 1 4.019 0.012 . 2 . . . A 7 GLY HA2 . c25525_2n0h 1 68 . 1 1 7 7 GLY HA3 H 1 3.860 0.004 . 2 . . . A 7 GLY HA3 . c25525_2n0h 1 69 . 1 1 7 7 GLY CA C 13 46.250 0.100 . 1 . . . A 7 GLY CA . c25525_2n0h 1 70 . 1 1 7 7 GLY N N 15 108.913 0.100 . 1 . . . A 7 GLY N . c25525_2n0h 1 71 . 1 1 8 8 HIS H H 1 7.982 0.006 . 1 . . . A 8 HIS H . c25525_2n0h 1 72 . 1 1 8 8 HIS HA H 1 4.402 0.006 . 1 . . . A 8 HIS HA . c25525_2n0h 1 73 . 1 1 8 8 HIS HB2 H 1 3.132 0.012 . 2 . . . A 8 HIS HB2 . c25525_2n0h 1 74 . 1 1 8 8 HIS HB3 H 1 2.977 0.006 . 2 . . . A 8 HIS HB3 . c25525_2n0h 1 75 . 1 1 8 8 HIS HD2 H 1 7.069 0.012 . 1 . . . A 8 HIS HD2 . c25525_2n0h 1 76 . 1 1 8 8 HIS HE1 H 1 8.031 0.010 . 1 . . . A 8 HIS HE1 . c25525_2n0h 1 77 . 1 1 8 8 HIS CA C 13 55.580 0.100 . 1 . . . A 8 HIS CA . c25525_2n0h 1 78 . 1 1 8 8 HIS CB C 13 28.210 0.100 . 1 . . . A 8 HIS CB . c25525_2n0h 1 79 . 1 1 8 8 HIS CD2 C 13 120.093 0.100 . 1 . . . A 8 HIS CD2 . c25525_2n0h 1 80 . 1 1 8 8 HIS CE1 C 13 136.622 0.100 . 1 . . . A 8 HIS CE1 . c25525_2n0h 1 81 . 1 1 8 8 HIS N N 15 116.605 0.100 . 1 . . . A 8 HIS N . c25525_2n0h 1 82 . 1 1 9 9 LEU H H 1 8.170 0.006 . 1 . . . A 9 LEU H . c25525_2n0h 1 83 . 1 1 9 9 LEU HA H 1 4.269 0.004 . 1 . . . A 9 LEU HA . c25525_2n0h 1 84 . 1 1 9 9 LEU HB2 H 1 1.839 0.004 . 2 . . . A 9 LEU HB2 . c25525_2n0h 1 85 . 1 1 9 9 LEU HB3 H 1 1.562 0.009 . 2 . . . A 9 LEU HB3 . c25525_2n0h 1 86 . 1 1 9 9 LEU HG H 1 1.603 0.016 . 1 . . . A 9 LEU HG . c25525_2n0h 1 87 . 1 1 9 9 LEU HD11 H 1 0.972 0.004 . 1 . . . A 9 LEU HD11 . c25525_2n0h 1 88 . 1 1 9 9 LEU HD12 H 1 0.972 0.004 . 1 . . . A 9 LEU HD12 . c25525_2n0h 1 89 . 1 1 9 9 LEU HD13 H 1 0.972 0.004 . 1 . . . A 9 LEU HD13 . c25525_2n0h 1 90 . 1 1 9 9 LEU HD21 H 1 0.916 0.005 . 1 . . . A 9 LEU HD21 . c25525_2n0h 1 91 . 1 1 9 9 LEU HD22 H 1 0.916 0.005 . 1 . . . A 9 LEU HD22 . c25525_2n0h 1 92 . 1 1 9 9 LEU HD23 H 1 0.916 0.005 . 1 . . . A 9 LEU HD23 . c25525_2n0h 1 93 . 1 1 9 9 LEU CA C 13 56.511 0.100 . 1 . . . A 9 LEU CA . c25525_2n0h 1 94 . 1 1 9 9 LEU CB C 13 42.422 0.100 . 1 . . . A 9 LEU CB . c25525_2n0h 1 95 . 1 1 9 9 LEU CG C 13 27.045 0.100 . 1 . . . A 9 LEU CG . c25525_2n0h 1 96 . 1 1 9 9 LEU CD1 C 13 25.375 0.100 . 1 . . . A 9 LEU CD1 . c25525_2n0h 1 97 . 1 1 9 9 LEU CD2 C 13 23.485 0.100 . 1 . . . A 9 LEU CD2 . c25525_2n0h 1 98 . 1 1 9 9 LEU N N 15 119.102 0.100 . 1 . . . A 9 LEU N . c25525_2n0h 1 99 . 1 1 10 10 MET H H 1 7.828 0.006 . 1 . . . A 10 MET H . c25525_2n0h 1 100 . 1 1 10 10 MET HA H 1 4.411 0.004 . 1 . . . A 10 MET HA . c25525_2n0h 1 101 . 1 1 10 10 MET HB2 H 1 2.162 0.004 . 2 . . . A 10 MET HB2 . c25525_2n0h 1 102 . 1 1 10 10 MET HB3 H 1 2.025 0.004 . 2 . . . A 10 MET HB3 . c25525_2n0h 1 103 . 1 1 10 10 MET HG2 H 1 2.634 0.012 . 2 . . . A 10 MET HG2 . c25525_2n0h 1 104 . 1 1 10 10 MET HG3 H 1 2.525 0.011 . 2 . . . A 10 MET HG3 . c25525_2n0h 1 105 . 1 1 10 10 MET HE1 H 1 2.084 0.010 . 1 . . . A 10 MET HE1 . c25525_2n0h 1 106 . 1 1 10 10 MET HE2 H 1 2.084 0.010 . 1 . . . A 10 MET HE2 . c25525_2n0h 1 107 . 1 1 10 10 MET HE3 H 1 2.084 0.010 . 1 . . . A 10 MET HE3 . c25525_2n0h 1 108 . 1 1 10 10 MET CA C 13 57.859 0.100 . 1 . . . A 10 MET CA . c25525_2n0h 1 109 . 1 1 10 10 MET CB C 13 33.032 0.100 . 1 . . . A 10 MET CB . c25525_2n0h 1 110 . 1 1 10 10 MET CG C 13 32.550 0.100 . 1 . . . A 10 MET CG . c25525_2n0h 1 111 . 1 1 10 10 MET CE C 13 17.049 0.100 . 1 . . . A 10 MET CE . c25525_2n0h 1 112 . 1 1 10 10 MET N N 15 115.971 0.100 . 1 . . . A 10 MET N . c25525_2n0h 1 113 . 1 1 11 11 NH2 HN1 H 1 7.206 0.012 . 2 . . . . 11 NH2 HN1 . c25525_2n0h 1 114 . 1 1 11 11 NH2 HN2 H 1 7.027 0.011 . 2 . . . . 11 NH2 HN2 . c25525_2n0h 1 115 . 1 1 11 11 NH2 N N 15 105.670 0.100 . 1 . . . . 11 NH2 N . c25525_2n0h 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID c25525_2n0h _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1000 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 9 '2D 15N- HET-NOE' . . . c25525_2n0h 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 2 $XEASY . . c25525_2n0h 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 ASN N N . . 1 1 2 2 ASN H H . -0.061 0.041 . . . 2 ASN N . 2 ASN H c25525_2n0h 1 2 . 1 1 3 3 HIS N N . . 1 1 3 3 HIS H H . 0.556 0.010 . . . 3 HIS N . 3 HIS H c25525_2n0h 1 3 . 1 1 4 4 TRP N N . . 1 1 4 4 TRP H H . 0.412 0.085 . . . 4 TRP N . 4 TRP H c25525_2n0h 1 4 . 1 1 4 4 TRP NE1 N . . 1 1 4 4 TRP HE1 H . 0.426 0.099 . . . 4 TRP NE1 . 4 TRP HE1 c25525_2n0h 1 5 . 1 1 5 5 ALA N N . . 1 1 5 5 ALA H H . 0.387 0.077 . . . 5 ALA N . 5 ALA H c25525_2n0h 1 6 . 1 1 6 6 VAL N N . . 1 1 6 6 VAL H H . 0.454 0.083 . . . 6 VAL N . 6 VAL H c25525_2n0h 1 7 . 1 1 7 7 GLY N N . . 1 1 7 7 GLY H H . 0.504 0.125 . . . 7 GLY N . 7 GLY H c25525_2n0h 1 8 . 1 1 8 8 HIS N N . . 1 1 8 8 HIS H H . 0.454 0.087 . . . 8 HIS N . 8 HIS H c25525_2n0h 1 9 . 1 1 9 9 LEU N N . . 1 1 9 9 LEU H H . 0.635 0.095 . . . 9 LEU N . 9 LEU H c25525_2n0h 1 10 . 1 1 10 10 MET N N . . 1 1 10 10 MET H H . 0.425 0.104 . . . 10 MET N . 10 MET H c25525_2n0h 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID c25525_2n0h _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Iz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 7 '2D 15N-T1' . . . c25525_2n0h 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 2 $XEASY . . c25525_2n0h 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 ASN N N 15 0.725 0.150 . . 2 ASN N c25525_2n0h 1 2 . 1 1 3 3 HIS N N 15 0.607 0.084 . . 3 HIS N c25525_2n0h 1 3 . 1 1 4 4 TRP N N 15 0.592 0.180 . . 4 TRP N c25525_2n0h 1 4 . 1 1 4 4 TRP NE1 N 15 0.681 0.085 . . 4 TRP NE1 c25525_2n0h 1 5 . 1 1 5 5 ALA N N 15 0.777 0.195 . . 5 ALA N c25525_2n0h 1 6 . 1 1 6 6 VAL N N 15 0.646 0.098 . . 6 VAL N c25525_2n0h 1 7 . 1 1 7 7 GLY N N 15 0.683 0.190 . . 7 GLY N c25525_2n0h 1 8 . 1 1 8 8 HIS N N 15 0.588 0.129 . . 8 HIS N c25525_2n0h 1 9 . 1 1 9 9 LEU N N 15 0.690 0.140 . . 9 LEU N c25525_2n0h 1 10 . 1 1 10 10 MET N N 15 0.571 0.078 . . 10 MET N c25525_2n0h 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID c25525_2n0h _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type I(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 8 '2D 15N-T2' . . . c25525_2n0h 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 2 $XEASY . . c25525_2n0h 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 ASN N N 15 0.229 0.039 . . . . 2 ASN N c25525_2n0h 1 2 . 1 1 3 3 HIS N N 15 0.121 0.020 . . . . 3 HIS N c25525_2n0h 1 3 . 1 1 4 4 TRP N N 15 0.118 0.049 . . . . 4 TRP N c25525_2n0h 1 4 . 1 1 4 4 TRP NE1 N 15 0.135 0.032 . . . . 4 TRP NE1 c25525_2n0h 1 5 . 1 1 5 5 ALA N N 15 0.079 0.047 . . . . 5 ALA N c25525_2n0h 1 6 . 1 1 6 6 VAL N N 15 0.085 0.035 . . . . 6 VAL N c25525_2n0h 1 7 . 1 1 7 7 GLY N N 15 0.100 0.033 . . . . 7 GLY N c25525_2n0h 1 8 . 1 1 8 8 HIS N N 15 0.084 0.008 . . . . 8 HIS N c25525_2n0h 1 9 . 1 1 9 9 LEU N N 15 0.126 0.050 . . . . 9 LEU N c25525_2n0h 1 10 . 1 1 10 10 MET N N 15 0.118 0.006 . . . . 10 MET N c25525_2n0h 1 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c25525_2n0h _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 20 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c25525_2n0h _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . c25525_2n0h 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . c25525_2n0h 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 GLY C C 0.888 9.406 -2.088 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 1 . 2 . 1 1 1 GLY CA C 1.791 9.249 -3.295 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 1 . 3 . 1 1 1 GLY H1 H 3.176 8.072 -2.417 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 1 . 4 . 1 1 1 GLY H2 H 3.713 8.838 -3.755 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 1 . 5 . 1 1 1 GLY H3 H 3.531 9.665 -2.359 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 1 . 6 . 1 1 1 GLY HA2 H 1.788 10.105 -3.811 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 1 . 7 . 1 1 1 GLY HA3 H 1.434 8.513 -3.869 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 1 . 8 . 1 1 1 GLY N N 3.159 8.931 -2.928 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 1 . 9 . 1 1 1 GLY O O 1.269 10.028 -1.097 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 1 . 10 . 1 1 2 ASN C C -1.092 7.763 -0.105 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 1 . 11 . 1 1 2 ASN CA C -1.272 8.925 -1.076 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 1 . 12 . 1 1 2 ASN CB C -2.701 8.930 -1.624 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 1 . 13 . 1 1 2 ASN CG C -3.052 7.638 -2.336 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 1 . 14 . 1 1 2 ASN H H -0.563 8.351 -3.004 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 1 . 15 . 1 1 2 ASN HA H -1.062 9.761 -0.569 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 1 . 16 . 1 1 2 ASN HB2 H -3.336 9.060 -0.863 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 17 . 1 1 2 ASN HB3 H -2.794 9.688 -2.269 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 18 . 1 1 2 ASN HD21 H -2.838 8.530 -4.139 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 1 . 19 . 1 1 2 ASN HD22 H -3.280 6.856 -4.188 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 1 . 20 . 1 1 2 ASN N N -0.312 8.843 -2.171 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 1 . 21 . 1 1 2 ASN ND2 N -3.057 7.678 -3.664 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 1 . 22 . 1 1 2 ASN O O -1.293 7.910 1.101 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 1 . 23 . 1 1 2 ASN OD1 O -3.314 6.617 -1.701 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 1 . 24 . 1 1 3 HIS C C 0.061 4.273 -0.656 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 1 . 25 . 1 1 3 HIS CA C -0.501 5.418 0.181 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 1 . 26 . 1 1 3 HIS CB C -1.815 4.986 0.837 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 1 . 27 . 1 1 3 HIS CD2 C -1.545 2.953 2.432 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 1 . 28 . 1 1 3 HIS CE1 C -1.351 4.066 4.306 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 1 . 29 . 1 1 3 HIS CG C -1.626 4.284 2.155 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 1 . 30 . 1 1 3 HIS H H -0.565 6.549 -1.627 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 1 . 31 . 1 1 3 HIS HA H 0.169 5.643 0.888 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 1 . 32 . 1 1 3 HIS HB2 H -2.376 5.799 0.991 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 33 . 1 1 3 HIS HB3 H -2.292 4.365 0.215 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 34 . 1 1 3 HIS HD2 H -1.601 2.204 1.772 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 1 . 35 . 1 1 3 HIS HE1 H -1.237 4.276 5.277 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 1 . 36 . 1 1 3 HIS HE2 H -1.275 1.989 4.328 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 1 . 37 . 1 1 3 HIS N N -0.711 6.606 -0.639 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 1 . 38 . 1 1 3 HIS ND1 N -1.502 4.971 3.351 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 1 . 39 . 1 1 3 HIS NE2 N -1.371 2.831 3.797 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 1 . 40 . 1 1 3 HIS O O -0.646 3.682 -1.471 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 1 . 41 . 1 1 4 TRP C C 1.914 1.579 -0.417 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 1 . 42 . 1 1 4 TRP CA C 1.995 2.894 -1.184 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 1 . 43 . 1 1 4 TRP CB C 3.457 3.253 -1.453 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 1 . 44 . 1 1 4 TRP CD1 C 4.498 2.080 -3.479 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 1 . 45 . 1 1 4 TRP CD2 C 4.798 1.004 -1.537 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 1 . 46 . 1 1 4 TRP CE2 C 5.413 0.260 -2.564 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 1 . 47 . 1 1 4 TRP CE3 C 4.858 0.521 -0.228 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 1 . 48 . 1 1 4 TRP CG C 4.219 2.164 -2.144 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 1 . 49 . 1 1 4 TRP CH2 C 6.120 -1.388 -1.026 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 1 . 50 . 1 1 4 TRP CZ2 C 6.077 -0.939 -2.318 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 1 . 51 . 1 1 4 TRP CZ3 C 5.517 -0.669 0.014 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 1 . 52 . 1 1 4 TRP H H 1.859 4.487 0.229 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 1 . 53 . 1 1 4 TRP HA H 1.496 2.770 -2.042 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 1 . 54 . 1 1 4 TRP HB2 H 3.484 4.071 -2.028 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 55 . 1 1 4 TRP HB3 H 3.904 3.445 -0.580 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 56 . 1 1 4 TRP HD1 H 4.221 2.751 -4.167 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 1 . 57 . 1 1 4 TRP HE1 H 5.541 0.645 -4.637 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 1 . 58 . 1 1 4 TRP HE3 H 4.432 1.027 0.522 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 1 . 59 . 1 1 4 TRP HH2 H 6.590 -2.246 -0.817 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 1 . 60 . 1 1 4 TRP HZ2 H 6.506 -1.451 -3.062 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 1 . 61 . 1 1 4 TRP HZ3 H 5.564 -1.022 0.948 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 1 . 62 . 1 1 4 TRP N N 1.337 3.968 -0.448 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 1 . 63 . 1 1 4 TRP NE1 N 5.215 0.937 -3.738 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 1 . 64 . 1 1 4 TRP O O 1.951 0.501 -1.009 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 1 . 65 . 1 1 5 ALA C C 0.562 -0.406 1.321 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 1 . 66 . 1 1 5 ALA CA C 1.717 0.492 1.752 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 1 . 67 . 1 1 5 ALA CB C 1.557 0.899 3.209 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 1 . 68 . 1 1 5 ALA H H 1.780 2.581 1.327 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 1 . 69 . 1 1 5 ALA HA H 2.568 -0.025 1.661 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 1 . 70 . 1 1 5 ALA HB1 H 0.722 1.440 3.312 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 1 . 71 . 1 1 5 ALA HB2 H 1.498 0.082 3.783 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 72 . 1 1 5 ALA HB3 H 2.346 1.447 3.488 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 73 . 1 1 5 ALA N N 1.804 1.675 0.904 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 1 . 74 . 1 1 5 ALA O O 0.582 -1.615 1.556 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 1 . 75 . 1 1 6 VAL C C -1.233 -1.513 -0.898 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 1 . 76 . 1 1 6 VAL CA C -1.607 -0.557 0.225 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 1 . 77 . 1 1 6 VAL CB C -2.720 0.387 -0.264 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 1 . 78 . 1 1 6 VAL CG1 C -2.264 1.155 -1.496 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 1 . 79 . 1 1 6 VAL CG2 C -3.992 -0.396 -0.557 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 1 . 80 . 1 1 6 VAL H H -0.403 1.177 0.530 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 1 . 81 . 1 1 6 VAL HA H -1.942 -1.105 0.991 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 1 . 82 . 1 1 6 VAL HB H -2.893 1.054 0.461 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 1 . 83 . 1 1 6 VAL HG11 H -2.043 0.516 -2.233 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 1 . 84 . 1 1 6 VAL HG12 H -3.006 1.758 -1.789 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 1 . 85 . 1 1 6 VAL HG13 H -1.457 1.703 -1.276 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 1 . 86 . 1 1 6 VAL HG21 H -4.303 -0.856 0.275 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 1 . 87 . 1 1 6 VAL HG22 H -4.700 0.236 -0.872 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 1 . 88 . 1 1 6 VAL HG23 H -3.812 -1.076 -1.267 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 1 . 89 . 1 1 6 VAL N N -0.444 0.191 0.690 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 1 . 90 . 1 1 6 VAL O O -1.858 -2.558 -1.074 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 1 . 91 . 1 1 7 GLY C C 1.041 -3.181 -2.293 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 1 . 92 . 1 1 7 GLY CA C 0.236 -1.987 -2.761 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 1 . 93 . 1 1 7 GLY H H 0.267 -0.288 -1.476 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 1 . 94 . 1 1 7 GLY HA2 H -0.568 -2.316 -3.256 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 1 . 95 . 1 1 7 GLY HA3 H 0.804 -1.438 -3.375 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 1 . 96 . 1 1 7 GLY N N -0.206 -1.149 -1.662 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 1 . 97 . 1 1 7 GLY O O 1.130 -4.193 -2.991 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 1 . 98 . 1 1 8 HIS C C 1.550 -5.270 -0.025 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 1 . 99 . 1 1 8 HIS CA C 2.439 -4.146 -0.548 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 1 . 100 . 1 1 8 HIS CB C 3.327 -3.617 0.580 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 1 . 101 . 1 1 8 HIS CD2 C 3.931 -5.159 2.579 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 1 . 102 . 1 1 8 HIS CE1 C 5.550 -6.275 1.618 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 1 . 103 . 1 1 8 HIS CG C 4.080 -4.697 1.306 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 1 . 104 . 1 1 8 HIS H H 1.525 -2.219 -0.588 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 1 . 105 . 1 1 8 HIS HA H 3.011 -4.518 -1.279 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 1 . 106 . 1 1 8 HIS HB2 H 3.990 -2.978 0.190 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 107 . 1 1 8 HIS HB3 H 2.750 -3.136 1.240 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 108 . 1 1 8 HIS HD2 H 3.269 -4.837 3.256 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 1 . 109 . 1 1 8 HIS HE1 H 6.294 -6.926 1.467 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 1 . 110 . 1 1 8 HIS HE2 H 5.031 -6.708 3.579 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 1 . 111 . 1 1 8 HIS N N 1.634 -3.066 -1.108 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 1 . 112 . 1 1 8 HIS ND1 N 5.107 -5.414 0.715 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 1 . 113 . 1 1 8 HIS NE2 N 4.870 -6.159 2.759 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 1 . 114 . 1 1 8 HIS O O 1.852 -6.451 -0.206 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 1 . 115 . 1 1 9 LEU C C -1.499 -6.305 0.130 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 1 . 116 . 1 1 9 LEU CA C -0.478 -5.875 1.179 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 1 . 117 . 1 1 9 LEU CB C -1.197 -5.291 2.397 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 1 . 118 . 1 1 9 LEU CD1 C -1.224 -3.709 4.341 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 1 . 119 . 1 1 9 LEU CD2 C 0.694 -5.287 4.042 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 1 . 120 . 1 1 9 LEU CG C -0.345 -4.432 3.331 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 1 . 121 . 1 1 9 LEU H H 0.264 -3.922 0.744 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 1 . 122 . 1 1 9 LEU HA H 0.043 -6.682 1.457 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 1 . 123 . 1 1 9 LEU HB2 H -1.952 -4.725 2.065 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 124 . 1 1 9 LEU HB3 H -1.562 -6.053 2.932 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 125 . 1 1 9 LEU HD11 H -1.727 -4.380 4.886 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 1 . 126 . 1 1 9 LEU HD12 H -0.650 -3.153 4.942 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 1 . 127 . 1 1 9 LEU HD13 H -1.871 -3.119 3.858 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 1 . 128 . 1 1 9 LEU HD21 H 1.282 -5.720 3.359 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 1 . 129 . 1 1 9 LEU HD22 H 1.251 -4.724 4.653 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 1 . 130 . 1 1 9 LEU HD23 H 0.226 -5.993 4.574 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 1 . 131 . 1 1 9 LEU HG H 0.157 -3.758 2.789 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 1 . 132 . 1 1 9 LEU N N 0.454 -4.897 0.628 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 1 . 133 . 1 1 9 LEU O O -1.699 -7.497 -0.103 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 1 . 134 . 1 1 10 MET C C -2.573 -5.341 -2.921 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 1 . 135 . 1 1 10 MET CA C -3.137 -5.605 -1.528 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 1 . 136 . 1 1 10 MET CB C -4.386 -4.752 -1.301 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 1 . 137 . 1 1 10 MET CE C -6.876 -6.064 1.647 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 1 . 138 . 1 1 10 MET CG C -4.923 -4.825 0.119 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 1 . 139 . 1 1 10 MET H H -1.934 -4.377 -0.266 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 1 . 140 . 1 1 10 MET HA H -3.371 -6.576 -1.472 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 1 . 141 . 1 1 10 MET HB2 H -4.160 -3.799 -1.504 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 1 . 142 . 1 1 10 MET HB3 H -5.102 -5.065 -1.925 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 1 . 143 . 1 1 10 MET HE1 H -6.525 -5.543 2.425 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 1 . 144 . 1 1 10 MET HE2 H -7.544 -5.511 1.149 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 1 . 145 . 1 1 10 MET HE3 H -7.315 -6.900 1.976 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 1 . 146 . 1 1 10 MET HG2 H -4.188 -4.569 0.747 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 1 . 147 . 1 1 10 MET HG3 H -5.677 -4.173 0.204 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 1 . 148 . 1 1 10 MET N N -2.140 -5.327 -0.501 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 1 . 149 . 1 1 10 MET O O -2.903 -6.039 -3.879 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 1 . 150 . 1 1 10 MET SD S -5.518 -6.471 0.552 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 2 . 151 . 1 1 1 GLY C C 1.252 9.465 -1.440 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 2 . 152 . 1 1 1 GLY CA C 2.312 9.377 -2.520 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 2 . 153 . 1 1 1 GLY H1 H 2.984 7.531 -2.055 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 2 . 154 . 1 1 1 GLY H2 H 4.044 8.421 -2.922 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 2 . 155 . 1 1 1 GLY H3 H 3.817 8.738 -1.336 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 2 . 156 . 1 1 1 GLY HA2 H 2.713 10.284 -2.651 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 2 . 157 . 1 1 1 GLY HA3 H 1.880 9.077 -3.370 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 2 . 158 . 1 1 1 GLY N N 3.372 8.444 -2.182 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 2 . 159 . 1 1 1 GLY O O 1.526 9.918 -0.328 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 2 . 160 . 1 1 2 ASN C C -1.134 7.774 -0.012 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 2 . 161 . 1 1 2 ASN CA C -1.067 9.069 -0.816 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 2 . 162 . 1 1 2 ASN CB C -2.390 9.297 -1.548 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 2 . 163 . 1 1 2 ASN CG C -2.626 10.758 -1.875 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 2 . 164 . 1 1 2 ASN H H -0.122 8.677 -2.686 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 2 . 165 . 1 1 2 ASN HA H -0.867 9.803 -0.166 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 2 . 166 . 1 1 2 ASN HB2 H -2.379 8.774 -2.401 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 167 . 1 1 2 ASN HB3 H -3.137 8.973 -0.968 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 168 . 1 1 2 ASN HD21 H -1.785 10.528 -3.700 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 2 . 169 . 1 1 2 ASN HD22 H -2.349 12.125 -3.340 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 2 . 170 . 1 1 2 ASN N N 0.038 9.034 -1.766 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 2 . 171 . 1 1 2 ASN ND2 N -2.220 11.171 -3.070 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 2 . 172 . 1 1 2 ASN O O -1.597 7.762 1.130 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 2 . 173 . 1 1 2 ASN OD1 O -3.167 11.508 -1.062 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 2 . 174 . 1 1 3 HIS C C 0.052 4.342 -0.800 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 2 . 175 . 1 1 3 HIS CA C -0.675 5.384 0.046 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 2 . 176 . 1 1 3 HIS CB C -2.108 4.929 0.312 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 2 . 177 . 1 1 3 HIS CD2 C -1.387 3.083 1.991 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 2 . 178 . 1 1 3 HIS CE1 C -3.175 3.110 3.254 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 2 . 179 . 1 1 3 HIS CG C -2.249 4.018 1.500 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 2 . 180 . 1 1 3 HIS H H -0.306 6.757 -1.544 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 2 . 181 . 1 1 3 HIS HA H -0.186 5.474 0.914 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 2 . 182 . 1 1 3 HIS HB2 H -2.673 5.739 0.470 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 183 . 1 1 3 HIS HB3 H -2.441 4.443 -0.496 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 184 . 1 1 3 HIS HD2 H -0.489 2.850 1.619 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 2 . 185 . 1 1 3 HIS HE1 H -3.825 2.894 3.982 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 2 . 186 . 1 1 3 HIS HE2 H -1.622 1.798 3.692 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 2 . 187 . 1 1 3 HIS N N -0.669 6.684 -0.615 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 2 . 188 . 1 1 3 HIS ND1 N -3.372 4.021 2.311 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 2 . 189 . 1 1 3 HIS NE2 N -1.987 2.517 3.100 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 2 . 190 . 1 1 3 HIS O O -0.459 3.897 -1.827 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 2 . 191 . 1 1 4 TRP C C 1.993 1.618 -0.376 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 2 . 192 . 1 1 4 TRP CA C 2.042 2.971 -1.078 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 2 . 193 . 1 1 4 TRP CB C 3.492 3.444 -1.199 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 2 . 194 . 1 1 4 TRP CD1 C 4.709 2.728 -3.338 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 2 . 195 . 1 1 4 TRP CD2 C 4.938 1.301 -1.626 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 2 . 196 . 1 1 4 TRP CE2 C 5.649 0.795 -2.731 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 2 . 197 . 1 1 4 TRP CE3 C 4.938 0.573 -0.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 2 . 198 . 1 1 4 TRP CG C 4.345 2.538 -2.035 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 2 . 199 . 1 1 4 TRP CH2 C 6.335 -1.099 -1.498 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 2 . 200 . 1 1 4 TRP CZ2 C 6.351 -0.406 -2.678 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 2 . 201 . 1 1 4 TRP CZ3 C 5.636 -0.619 -0.382 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 2 . 202 . 1 1 4 TRP H H 1.606 4.358 0.482 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 2 . 203 . 1 1 4 TRP HA H 1.630 2.853 -1.981 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 2 . 204 . 1 1 4 TRP HB2 H 3.497 4.354 -1.614 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 205 . 1 1 4 TRP HB3 H 3.889 3.494 -0.283 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 206 . 1 1 4 TRP HD1 H 4.444 3.512 -3.900 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 2 . 207 . 1 1 4 TRP HE1 H 5.887 1.585 -4.677 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 2 . 208 . 1 1 4 TRP HE3 H 4.443 0.907 0.369 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 2 . 209 . 1 1 4 TRP HH2 H 6.831 -1.965 -1.428 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 2 . 210 . 1 1 4 TRP HZ2 H 6.848 -0.747 -3.476 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 2 . 211 . 1 1 4 TRP HZ3 H 5.642 -1.148 0.467 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 2 . 212 . 1 1 4 TRP N N 1.245 3.959 -0.361 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 2 . 213 . 1 1 4 TRP NE1 N 5.493 1.683 -3.763 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 2 . 214 . 1 1 4 TRP O O 2.077 0.572 -1.018 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 2 . 215 . 1 1 5 ALA C C 0.628 -0.457 1.289 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 2 . 216 . 1 1 5 ALA CA C 1.791 0.423 1.734 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 2 . 217 . 1 1 5 ALA CB C 1.669 0.754 3.214 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 2 . 218 . 1 1 5 ALA H H 1.794 2.530 1.411 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 2 . 219 . 1 1 5 ALA HA H 2.641 -0.085 1.596 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 2 . 220 . 1 1 5 ALA HB1 H 0.837 1.287 3.366 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 2 . 221 . 1 1 5 ALA HB2 H 1.626 -0.091 3.747 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 222 . 1 1 5 ALA HB3 H 2.464 1.288 3.500 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 223 . 1 1 5 ALA N N 1.855 1.647 0.946 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 2 . 224 . 1 1 5 ALA O O 0.657 -1.676 1.463 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 2 . 225 . 1 1 6 VAL C C -1.204 -1.526 -0.873 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 2 . 226 . 1 1 6 VAL CA C -1.570 -0.559 0.245 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 2 . 227 . 1 1 6 VAL CB C -2.661 0.405 -0.256 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 2 . 228 . 1 1 6 VAL CG1 C -2.151 1.221 -1.434 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 2 . 229 . 1 1 6 VAL CG2 C -3.916 -0.366 -0.636 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 2 . 230 . 1 1 6 VAL H H -0.359 1.162 0.605 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 2 . 231 . 1 1 6 VAL HA H -1.921 -1.098 1.011 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 2 . 232 . 1 1 6 VAL HB H -2.868 1.042 0.486 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 2 . 233 . 1 1 6 VAL HG11 H -1.896 0.612 -2.185 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 2 . 234 . 1 1 6 VAL HG12 H -2.880 1.836 -1.736 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 2 . 235 . 1 1 6 VAL HG13 H -1.355 1.759 -1.156 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 2 . 236 . 1 1 6 VAL HG21 H -4.263 -0.859 0.162 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 2 . 237 . 1 1 6 VAL HG22 H -4.609 0.279 -0.958 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 2 . 238 . 1 1 6 VAL HG23 H -3.704 -1.018 -1.364 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 2 . 239 . 1 1 6 VAL N N -0.395 0.169 0.716 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 2 . 240 . 1 1 6 VAL O O -1.802 -2.593 -1.005 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 2 . 241 . 1 1 7 GLY C C 1.020 -3.184 -2.311 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 2 . 242 . 1 1 7 GLY CA C 0.211 -1.991 -2.779 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 2 . 243 . 1 1 7 GLY H H 0.234 -0.267 -1.528 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 2 . 244 . 1 1 7 GLY HA2 H -0.598 -2.322 -3.264 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 2 . 245 . 1 1 7 GLY HA3 H 0.773 -1.447 -3.402 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 2 . 246 . 1 1 7 GLY N N -0.218 -1.146 -1.680 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 2 . 247 . 1 1 7 GLY O O 1.133 -4.183 -3.021 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 2 . 248 . 1 1 8 HIS C C 1.503 -5.273 -0.007 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 2 . 249 . 1 1 8 HIS CA C 2.392 -4.159 -0.551 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 2 . 250 . 1 1 8 HIS CB C 3.296 -3.625 0.561 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 2 . 251 . 1 1 8 HIS CD2 C 4.036 -5.364 2.343 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 2 . 252 . 1 1 8 HIS CE1 C 5.877 -6.029 1.364 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 2 . 253 . 1 1 8 HIS CG C 4.179 -4.676 1.174 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 2 . 254 . 1 1 8 HIS H H 1.458 -2.241 -0.584 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 2 . 255 . 1 1 8 HIS HA H 2.954 -4.541 -1.284 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 2 . 256 . 1 1 8 HIS HB2 H 3.879 -2.907 0.180 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 257 . 1 1 8 HIS HB3 H 2.720 -3.239 1.281 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 258 . 1 1 8 HIS HD2 H 3.288 -5.270 3.000 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 2 . 259 . 1 1 8 HIS HE1 H 6.729 -6.518 1.178 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 2 . 260 . 1 1 8 HIS HE2 H 5.321 -6.861 3.186 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 2 . 261 . 1 1 8 HIS N N 1.587 -3.080 -1.113 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 2 . 262 . 1 1 8 HIS ND1 N 5.347 -5.110 0.571 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 2 . 263 . 1 1 8 HIS NE2 N 5.119 -6.216 2.448 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 2 . 264 . 1 1 8 HIS O O 1.909 -6.435 0.047 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 2 . 265 . 1 1 9 LEU C C -1.615 -6.369 -0.146 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 2 . 266 . 1 1 9 LEU CA C -0.657 -5.881 0.936 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 2 . 267 . 1 1 9 LEU CB C -1.448 -5.263 2.090 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 2 . 268 . 1 1 9 LEU CD1 C -1.551 -3.783 4.111 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 2 . 269 . 1 1 9 LEU CD2 C 0.348 -5.388 3.835 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 2 . 270 . 1 1 9 LEU CG C -0.632 -4.473 3.115 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 2 . 271 . 1 1 9 LEU H H 0.018 -3.951 0.325 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 2 . 272 . 1 1 9 LEU HA H -0.140 -6.668 1.273 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 2 . 273 . 1 1 9 LEU HB2 H -2.128 -4.643 1.698 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 274 . 1 1 9 LEU HB3 H -1.912 -6.004 2.575 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 275 . 1 1 9 LEU HD11 H -2.157 -3.153 3.625 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 2 . 276 . 1 1 9 LEU HD12 H -2.098 -4.469 4.591 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 2 . 277 . 1 1 9 LEU HD13 H -1.001 -3.273 4.772 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 2 . 278 . 1 1 9 LEU HD21 H 0.965 -5.798 3.163 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 2 . 279 . 1 1 9 LEU HD22 H 0.881 -4.870 4.505 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 2 . 280 . 1 1 9 LEU HD23 H -0.163 -6.110 4.302 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 2 . 281 . 1 1 9 LEU HG H -0.086 -3.784 2.638 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 2 . 282 . 1 1 9 LEU N N 0.289 -4.911 0.395 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 2 . 283 . 1 1 9 LEU O O -1.995 -7.540 -0.171 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 2 . 284 . 1 1 10 MET C C -2.138 -6.117 -3.407 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 2 . 285 . 1 1 10 MET CA C -2.910 -5.804 -2.129 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 2 . 286 . 1 1 10 MET CB C -3.890 -4.657 -2.379 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 2 . 287 . 1 1 10 MET CE C -7.560 -4.264 -0.513 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 2 . 288 . 1 1 10 MET CG C -4.899 -4.464 -1.258 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 2 . 289 . 1 1 10 MET H H -1.655 -4.528 -0.967 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 2 . 290 . 1 1 10 MET HA H -3.409 -6.629 -1.864 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 2 . 291 . 1 1 10 MET HB2 H -3.368 -3.811 -2.483 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 2 . 292 . 1 1 10 MET HB3 H -4.390 -4.846 -3.224 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 2 . 293 . 1 1 10 MET HE1 H -7.561 -5.261 -0.439 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 2 . 294 . 1 1 10 MET HE2 H -7.237 -3.866 0.346 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 2 . 295 . 1 1 10 MET HE3 H -8.488 -3.943 -0.701 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 2 . 296 . 1 1 10 MET HG2 H -5.073 -5.353 -0.835 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 2 . 297 . 1 1 10 MET HG3 H -4.502 -3.845 -0.581 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 2 . 298 . 1 1 10 MET N N -1.999 -5.464 -1.041 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 2 . 299 . 1 1 10 MET O O -2.721 -6.219 -4.487 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 2 . 300 . 1 1 10 MET SD S -6.460 -3.775 -1.838 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 3 . 301 . 1 1 1 GLY C C -0.948 9.484 -2.659 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 3 . 302 . 1 1 1 GLY CA C -2.248 9.851 -3.346 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 3 . 303 . 1 1 1 GLY H1 H -1.796 9.088 -5.159 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 3 . 304 . 1 1 1 GLY H2 H -2.987 10.206 -5.191 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 3 . 305 . 1 1 1 GLY H3 H -1.433 10.672 -5.000 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 3 . 306 . 1 1 1 GLY HA2 H -2.564 10.729 -2.986 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 3 . 307 . 1 1 1 GLY HA3 H -2.927 9.145 -3.145 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 3 . 308 . 1 1 1 GLY N N -2.105 9.963 -4.786 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 3 . 309 . 1 1 1 GLY O O 0.087 9.345 -3.310 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 3 . 310 . 1 1 2 ASN C C -0.027 7.667 0.187 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 3 . 311 . 1 1 2 ASN CA C 0.184 8.978 -0.565 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 3 . 312 . 1 1 2 ASN CB C 0.522 10.097 0.423 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 3 . 313 . 1 1 2 ASN CG C -0.571 10.309 1.451 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 3 . 314 . 1 1 2 ASN H H -1.874 9.454 -0.868 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 3 . 315 . 1 1 2 ASN HA H 0.923 8.820 -1.220 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 3 . 316 . 1 1 2 ASN HB2 H 1.369 9.860 0.898 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 317 . 1 1 2 ASN HB3 H 0.653 10.947 -0.087 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 318 . 1 1 2 ASN HD21 H 0.680 11.390 2.617 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 3 . 319 . 1 1 2 ASN HD22 H -0.927 11.199 3.233 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 3 . 320 . 1 1 2 ASN N N -1.001 9.328 -1.340 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 3 . 321 . 1 1 2 ASN ND2 N -0.246 11.025 2.522 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 3 . 322 . 1 1 2 ASN O O 0.178 7.594 1.399 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 3 . 323 . 1 1 2 ASN OD1 O -1.696 9.837 1.285 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 3 . 324 . 1 1 3 HIS C C -0.001 4.225 -0.760 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 3 . 325 . 1 1 3 HIS CA C -0.673 5.324 0.057 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 3 . 326 . 1 1 3 HIS CB C -2.172 5.050 0.160 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 3 . 327 . 1 1 3 HIS CD2 C -1.828 3.122 1.866 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 3 . 328 . 1 1 3 HIS CE1 C -3.783 3.234 2.844 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 3 . 329 . 1 1 3 HIS CG C -2.547 4.122 1.283 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 3 . 330 . 1 1 3 HIS H H -0.585 6.755 -1.523 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 3 . 331 . 1 1 3 HIS HA H -0.268 5.323 0.971 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 3 . 332 . 1 1 3 HIS HB2 H -2.644 5.920 0.302 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 333 . 1 1 3 HIS HB3 H -2.479 4.641 -0.700 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 334 . 1 1 3 HIS HD2 H -0.899 2.840 1.626 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 3 . 335 . 1 1 3 HIS HE1 H -4.549 3.043 3.458 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 3 . 336 . 1 1 3 HIS HE2 H -2.399 1.817 3.469 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 3 . 337 . 1 1 3 HIS N N -0.436 6.633 -0.542 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 3 . 338 . 1 1 3 HIS ND1 N -3.779 4.177 1.914 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 3 . 339 . 1 1 3 HIS NE2 N -2.624 2.571 2.852 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 3 . 340 . 1 1 3 HIS O O -0.615 3.631 -1.646 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 3 . 341 . 1 1 4 TRP C C 1.962 1.603 -0.416 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 3 . 342 . 1 1 4 TRP CA C 2.021 2.931 -1.161 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 3 . 343 . 1 1 4 TRP CB C 3.477 3.368 -1.335 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 3 . 344 . 1 1 4 TRP CD1 C 4.614 2.373 -3.404 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 3 . 345 . 1 1 4 TRP CD2 C 4.957 1.214 -1.519 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 3 . 346 . 1 1 4 TRP CE2 C 5.630 0.566 -2.573 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 3 . 347 . 1 1 4 TRP CE3 C 5.029 0.666 -0.235 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 3 . 348 . 1 1 4 TRP CG C 4.314 2.367 -2.072 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 3 . 349 . 1 1 4 TRP CH2 C 6.419 -1.115 -1.114 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 3 . 350 . 1 1 4 TRP CZ2 C 6.365 -0.600 -2.380 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 3 . 351 . 1 1 4 TRP CZ3 C 5.759 -0.492 -0.046 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 3 . 352 . 1 1 4 TRP H H 1.710 4.476 0.276 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 3 . 353 . 1 1 4 TRP HA H 1.582 2.794 -2.049 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 3 . 354 . 1 1 4 TRP HB2 H 3.493 4.228 -1.844 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 355 . 1 1 4 TRP HB3 H 3.878 3.509 -0.430 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 356 . 1 1 4 TRP HD1 H 4.304 3.062 -4.060 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 3 . 357 . 1 1 4 TRP HE1 H 5.762 1.069 -4.619 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 3 . 358 . 1 1 4 TRP HE3 H 4.561 1.103 0.533 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 3 . 359 . 1 1 4 TRP HH2 H 6.939 -1.952 -0.944 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 3 . 360 . 1 1 4 TRP HZ2 H 6.836 -1.043 -3.143 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 3 . 361 . 1 1 4 TRP HZ3 H 5.817 -0.892 0.869 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 3 . 362 . 1 1 4 TRP N N 1.265 3.959 -0.455 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 3 . 363 . 1 1 4 TRP NE1 N 5.406 1.292 -3.712 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 3 . 364 . 1 1 4 TRP O O 2.058 0.536 -1.022 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 3 . 365 . 1 1 5 ALA C C 0.569 -0.417 1.299 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 3 . 366 . 1 1 5 ALA CA C 1.728 0.476 1.729 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 3 . 367 . 1 1 5 ALA CB C 1.588 0.856 3.195 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 3 . 368 . 1 1 5 ALA H H 1.731 2.573 1.337 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 3 . 369 . 1 1 5 ALA HA H 2.579 -0.037 1.617 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 3 . 370 . 1 1 5 ALA HB1 H 0.754 1.394 3.320 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 3 . 371 . 1 1 5 ALA HB2 H 1.538 0.029 3.755 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 372 . 1 1 5 ALA HB3 H 2.380 1.399 3.473 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 373 . 1 1 5 ALA N N 1.802 1.675 0.902 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 3 . 374 . 1 1 5 ALA O O 0.610 -1.633 1.480 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 3 . 375 . 1 1 6 VAL C C -1.276 -1.489 -0.869 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 3 . 376 . 1 1 6 VAL CA C -1.634 -0.544 0.271 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 3 . 377 . 1 1 6 VAL CB C -2.752 0.406 -0.193 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 3 . 378 . 1 1 6 VAL CG1 C -2.297 1.216 -1.400 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 3 . 379 . 1 1 6 VAL CG2 C -4.017 -0.376 -0.515 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 3 . 380 . 1 1 6 VAL H H -0.436 1.189 0.609 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 3 . 381 . 1 1 6 VAL HA H -1.960 -1.100 1.036 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 3 . 382 . 1 1 6 VAL HB H -2.933 1.049 0.551 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 3 . 383 . 1 1 6 VAL HG11 H -1.495 1.762 -1.160 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 3 . 384 . 1 1 6 VAL HG12 H -2.068 0.602 -2.155 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 3 . 385 . 1 1 6 VAL HG13 H -3.042 1.822 -1.678 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 3 . 386 . 1 1 6 VAL HG21 H -4.328 -0.864 0.301 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 3 . 387 . 1 1 6 VAL HG22 H -4.728 0.261 -0.814 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 3 . 388 . 1 1 6 VAL HG23 H -3.830 -1.033 -1.245 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 3 . 389 . 1 1 6 VAL N N -0.463 0.196 0.728 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 3 . 390 . 1 1 6 VAL O O -1.915 -2.524 -1.056 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 3 . 391 . 1 1 7 GLY C C 1.277 -2.923 -2.360 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 3 . 392 . 1 1 7 GLY CA C 0.178 -1.953 -2.745 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 3 . 393 . 1 1 7 GLY H H 0.235 -0.273 -1.435 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 3 . 394 . 1 1 7 GLY HA2 H -0.608 -2.474 -3.077 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 3 . 395 . 1 1 7 GLY HA3 H 0.516 -1.358 -3.475 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 3 . 396 . 1 1 7 GLY N N -0.249 -1.126 -1.631 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 3 . 397 . 1 1 7 GLY O O 2.024 -3.397 -3.216 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 3 . 398 . 1 1 8 HIS C C 1.751 -5.388 0.027 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 3 . 399 . 1 1 8 HIS CA C 2.392 -4.139 -0.571 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 3 . 400 . 1 1 8 HIS CB C 3.266 -3.450 0.479 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 3 . 401 . 1 1 8 HIS CD2 C 4.333 -4.945 2.315 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 3 . 402 . 1 1 8 HIS CE1 C 6.138 -5.522 1.220 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 3 . 403 . 1 1 8 HIS CG C 4.302 -4.356 1.087 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 3 . 404 . 1 1 8 HIS H H 0.738 -2.803 -0.421 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 3 . 405 . 1 1 8 HIS HA H 2.959 -4.422 -1.344 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 3 . 406 . 1 1 8 HIS HB2 H 3.736 -2.680 0.046 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 407 . 1 1 8 HIS HB3 H 2.675 -3.111 1.211 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 408 . 1 1 8 HIS HD2 H 3.641 -4.862 3.033 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 3 . 409 . 1 1 8 HIS HE1 H 7.016 -5.944 0.993 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 3 . 410 . 1 1 8 HIS HE2 H 5.833 -6.235 3.145 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 3 . 411 . 1 1 8 HIS N N 1.376 -3.220 -1.068 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 3 . 412 . 1 1 8 HIS ND1 N 5.450 -4.732 0.410 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 3 . 413 . 1 1 8 HIS NE2 N 5.502 -5.680 2.382 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 3 . 414 . 1 1 8 HIS O O 2.333 -6.473 -0.004 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 3 . 415 . 1 1 9 LEU C C -1.304 -6.813 0.271 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 3 . 416 . 1 1 9 LEU CA C -0.172 -6.340 1.178 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 3 . 417 . 1 1 9 LEU CB C -0.732 -5.929 2.541 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 3 . 418 . 1 1 9 LEU CD1 C -0.494 -4.577 4.638 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 3 . 419 . 1 1 9 LEU CD2 C 1.272 -6.236 4.017 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 3 . 420 . 1 1 9 LEU CG C 0.250 -5.239 3.488 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 3 . 421 . 1 1 9 LEU H H 0.130 -4.318 0.565 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 3 . 422 . 1 1 9 LEU HA H 0.468 -7.098 1.300 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 3 . 423 . 1 1 9 LEU HB2 H -1.495 -5.302 2.383 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 424 . 1 1 9 LEU HB3 H -1.067 -6.754 2.996 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 425 . 1 1 9 LEU HD11 H -1.129 -3.894 4.276 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 3 . 426 . 1 1 9 LEU HD12 H -1.004 -5.269 5.148 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 3 . 427 . 1 1 9 LEU HD13 H 0.163 -4.132 5.246 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 3 . 428 . 1 1 9 LEU HD21 H 1.774 -6.628 3.246 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 3 . 429 . 1 1 9 LEU HD22 H 1.913 -5.783 4.636 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 3 . 430 . 1 1 9 LEU HD23 H 0.793 -6.964 4.508 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 3 . 431 . 1 1 9 LEU HG H 0.760 -4.543 2.982 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 3 . 432 . 1 1 9 LEU N N 0.550 -5.226 0.571 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 3 . 433 . 1 1 9 LEU O O -1.329 -7.966 -0.157 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 3 . 434 . 1 1 10 MET C C -2.922 -6.437 -2.319 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 3 . 435 . 1 1 10 MET CA C -3.372 -6.237 -0.876 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 3 . 436 . 1 1 10 MET CB C -4.425 -5.130 -0.806 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 3 . 437 . 1 1 10 MET CE C -7.357 -4.489 1.799 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 3 . 438 . 1 1 10 MET CG C -4.874 -4.805 0.610 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 3 . 439 . 1 1 10 MET H H -2.164 -4.992 0.365 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 3 . 440 . 1 1 10 MET HA H -3.762 -7.100 -0.555 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 3 . 441 . 1 1 10 MET HB2 H -4.041 -4.301 -1.213 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 3 . 442 . 1 1 10 MET HB3 H -5.225 -5.420 -1.332 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 3 . 443 . 1 1 10 MET HE1 H -7.589 -5.391 1.435 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 3 . 444 . 1 1 10 MET HE2 H -6.892 -4.594 2.678 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 3 . 445 . 1 1 10 MET HE3 H -8.193 -3.955 1.926 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 3 . 446 . 1 1 10 MET HG2 H -5.143 -5.658 1.058 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 3 . 447 . 1 1 10 MET HG3 H -4.102 -4.401 1.100 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 3 . 448 . 1 1 10 MET N N -2.239 -5.913 -0.017 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 3 . 449 . 1 1 10 MET O O -3.663 -6.145 -3.258 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 3 . 450 . 1 1 10 MET SD S -6.262 -3.656 0.652 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 4 . 451 . 1 1 1 GLY C C 1.505 8.955 -0.790 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 4 . 452 . 1 1 1 GLY CA C 2.701 9.026 -1.718 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 4 . 453 . 1 1 1 GLY H1 H 3.350 7.136 -1.431 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 4 . 454 . 1 1 1 GLY H2 H 4.494 8.146 -2.014 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 4 . 455 . 1 1 1 GLY H3 H 4.051 8.232 -0.444 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 4 . 456 . 1 1 1 GLY HA2 H 3.094 9.944 -1.666 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 4 . 457 . 1 1 1 GLY HA3 H 2.393 8.848 -2.653 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 4 . 458 . 1 1 1 GLY N N 3.729 8.060 -1.375 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 4 . 459 . 1 1 1 GLY O O 1.653 8.707 0.406 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 4 . 460 . 1 1 2 ASN C C -1.054 7.796 0.163 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 4 . 461 . 1 1 2 ASN CA C -0.911 9.134 -0.553 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 4 . 462 . 1 1 2 ASN CB C -2.126 9.379 -1.450 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 4 . 463 . 1 1 2 ASN CG C -2.396 10.855 -1.669 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 4 . 464 . 1 1 2 ASN H H 0.261 9.369 -2.320 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 4 . 465 . 1 1 2 ASN HA H -0.822 9.833 0.156 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 4 . 466 . 1 1 2 ASN HB2 H -1.962 8.947 -2.337 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 467 . 1 1 2 ASN HB3 H -2.929 8.965 -1.022 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 468 . 1 1 2 ASN HD21 H -3.912 10.429 -2.938 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 4 . 469 . 1 1 2 ASN HD22 H -3.613 12.115 -2.680 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 4 . 470 . 1 1 2 ASN N N 0.316 9.173 -1.341 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 4 . 471 . 1 1 2 ASN ND2 N -3.389 11.158 -2.497 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 4 . 472 . 1 1 2 ASN O O -1.588 7.726 1.271 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 4 . 473 . 1 1 2 ASN OD1 O -1.720 11.712 -1.100 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 4 . 474 . 1 1 3 HIS C C 0.077 4.384 -0.781 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 4 . 475 . 1 1 3 HIS CA C -0.649 5.396 0.100 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 4 . 476 . 1 1 3 HIS CB C -2.106 4.975 0.284 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 4 . 477 . 1 1 3 HIS CD2 C -1.465 3.087 1.947 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 4 . 478 . 1 1 3 HIS CE1 C -3.381 2.952 3.000 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 4 . 479 . 1 1 3 HIS CG C -2.322 3.997 1.406 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 4 . 480 . 1 1 3 HIS H H -0.153 6.854 -1.375 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 4 . 481 . 1 1 3 HIS HA H -0.193 5.416 0.990 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 4 . 482 . 1 1 3 HIS HB2 H -2.650 5.793 0.472 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 483 . 1 1 3 HIS HB3 H -2.423 4.552 -0.565 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 484 . 1 1 3 HIS HD2 H -0.519 2.922 1.669 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 4 . 485 . 1 1 3 HIS HE1 H -4.094 2.664 3.639 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 4 . 486 . 1 1 3 HIS HE2 H -1.814 1.706 3.554 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 4 . 487 . 1 1 3 HIS N N -0.575 6.733 -0.476 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 4 . 488 . 1 1 3 HIS ND1 N -3.526 3.898 2.084 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 4 . 489 . 1 1 3 HIS NE2 N -2.151 2.433 2.956 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 4 . 490 . 1 1 3 HIS O O -0.417 4.005 -1.844 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 4 . 491 . 1 1 4 TRP C C 1.981 1.606 -0.430 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 4 . 492 . 1 1 4 TRP CA C 2.043 2.983 -1.084 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 4 . 493 . 1 1 4 TRP CB C 3.497 3.450 -1.179 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 4 . 494 . 1 1 4 TRP CD1 C 4.651 2.841 -3.386 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 4 . 495 . 1 1 4 TRP CD2 C 4.968 1.355 -1.740 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 4 . 496 . 1 1 4 TRP CE2 C 5.648 0.905 -2.888 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 4 . 497 . 1 1 4 TRP CE3 C 5.025 0.581 -0.577 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 4 . 498 . 1 1 4 TRP CG C 4.336 2.595 -2.080 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 4 . 499 . 1 1 4 TRP CH2 C 6.414 -1.019 -1.753 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 4 . 500 . 1 1 4 TRP CZ2 C 6.375 -0.282 -2.905 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 4 . 501 . 1 1 4 TRP CZ3 C 5.746 -0.597 -0.596 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 4 . 502 . 1 1 4 TRP H H 1.596 4.294 0.538 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 4 . 503 . 1 1 4 TRP HA H 1.634 2.901 -1.993 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 4 . 504 . 1 1 4 TRP HB2 H 3.510 4.386 -1.531 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 505 . 1 1 4 TRP HB3 H 3.899 3.433 -0.263 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 506 . 1 1 4 TRP HD1 H 4.352 3.640 -3.908 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 4 . 507 . 1 1 4 TRP HE1 H 5.802 1.774 -4.808 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 4 . 508 . 1 1 4 TRP HE3 H 4.553 0.874 0.254 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 4 . 509 . 1 1 4 TRP HH2 H 6.929 -1.876 -1.734 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 4 . 510 . 1 1 4 TRP HZ2 H 6.850 -0.582 -3.732 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 4 . 511 . 1 1 4 TRP HZ3 H 5.791 -1.158 0.231 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 4 . 512 . 1 1 4 TRP N N 1.249 3.950 -0.334 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 4 . 513 . 1 1 4 TRP NE1 N 5.439 1.829 -3.878 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 4 . 514 . 1 1 4 TRP O O 2.055 0.583 -1.110 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 4 . 515 . 1 1 5 ALA C C 0.592 -0.510 1.168 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 4 . 516 . 1 1 5 ALA CA C 1.770 0.337 1.636 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 4 . 517 . 1 1 5 ALA CB C 1.663 0.616 3.127 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 4 . 518 . 1 1 5 ALA H H 1.790 2.454 1.388 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 4 . 519 . 1 1 5 ALA HA H 2.612 -0.177 1.473 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 4 . 520 . 1 1 5 ALA HB1 H 2.467 1.130 3.426 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 4 . 521 . 1 1 5 ALA HB2 H 0.839 1.154 3.305 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 522 . 1 1 5 ALA HB3 H 1.613 -0.247 3.630 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 523 . 1 1 5 ALA N N 1.844 1.588 0.892 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 4 . 524 . 1 1 5 ALA O O 0.623 -1.738 1.254 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 4 . 525 . 1 1 6 VAL C C -1.286 -1.528 -0.915 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 4 . 526 . 1 1 6 VAL CA C -1.638 -0.540 0.189 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 4 . 527 . 1 1 6 VAL CB C -2.688 0.452 -0.338 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 4 . 528 . 1 1 6 VAL CG1 C -2.122 1.271 -1.488 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 4 . 529 . 1 1 6 VAL CG2 C -3.948 -0.285 -0.769 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 4 . 530 . 1 1 6 VAL H H -0.414 1.151 0.629 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 4 . 531 . 1 1 6 VAL HA H -2.019 -1.061 0.953 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 4 . 532 . 1 1 6 VAL HB H -2.907 1.085 0.404 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 4 . 533 . 1 1 6 VAL HG11 H -1.325 1.788 -1.176 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 4 . 534 . 1 1 6 VAL HG12 H -1.854 0.665 -2.237 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 4 . 535 . 1 1 6 VAL HG13 H -2.826 1.905 -1.808 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 4 . 536 . 1 1 6 VAL HG21 H -4.334 -0.777 0.011 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 4 . 537 . 1 1 6 VAL HG22 H -4.615 0.379 -1.107 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 4 . 538 . 1 1 6 VAL HG23 H -3.726 -0.935 -1.496 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 4 . 539 . 1 1 6 VAL N N -0.448 0.153 0.672 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 4 . 540 . 1 1 6 VAL O O -1.928 -2.569 -1.060 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 4 . 541 . 1 1 7 GLY C C 1.019 -3.216 -2.302 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 4 . 542 . 1 1 7 GLY CA C 0.156 -2.065 -2.782 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 4 . 543 . 1 1 7 GLY H H 0.224 -0.337 -1.536 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 4 . 544 . 1 1 7 GLY HA2 H -0.658 -2.438 -3.227 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 4 . 545 . 1 1 7 GLY HA3 H 0.679 -1.525 -3.442 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 4 . 546 . 1 1 7 GLY N N -0.263 -1.196 -1.697 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 4 . 547 . 1 1 7 GLY O O 1.152 -4.229 -2.988 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 4 . 548 . 1 1 8 HIS C C 1.642 -5.098 0.250 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 4 . 549 . 1 1 8 HIS CA C 2.465 -4.093 -0.551 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 4 . 550 . 1 1 8 HIS CB C 3.533 -3.465 0.345 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 4 . 551 . 1 1 8 HIS CD2 C 4.399 -5.132 2.136 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 4 . 552 . 1 1 8 HIS CE1 C 6.234 -5.747 1.110 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 4 . 553 . 1 1 8 HIS CG C 4.477 -4.466 0.950 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 4 . 554 . 1 1 8 HIS H H 1.462 -2.211 -0.611 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 4 . 555 . 1 1 8 HIS HA H 2.904 -4.582 -1.304 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 4 . 556 . 1 1 8 HIS HB2 H 4.067 -2.820 -0.202 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 557 . 1 1 8 HIS HB3 H 3.076 -2.975 1.087 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 558 . 1 1 8 HIS HD2 H 3.670 -5.053 2.816 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 4 . 559 . 1 1 8 HIS HE1 H 7.099 -6.206 0.906 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 4 . 560 . 1 1 8 HIS HE2 H 5.774 -6.560 2.966 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 4 . 561 . 1 1 8 HIS N N 1.609 -3.059 -1.121 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 4 . 562 . 1 1 8 HIS ND1 N 5.642 -4.868 0.316 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 4 . 563 . 1 1 8 HIS NE2 N 5.521 -5.940 2.223 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 4 . 564 . 1 1 8 HIS O O 1.981 -6.280 0.316 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 4 . 565 . 1 1 9 LEU C C -1.492 -5.972 0.828 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 4 . 566 . 1 1 9 LEU CA C -0.310 -5.478 1.655 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 4 . 567 . 1 1 9 LEU CB C -0.814 -4.722 2.884 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 4 . 568 . 1 1 9 LEU CD1 C -0.393 -3.196 4.830 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 4 . 569 . 1 1 9 LEU CD2 C 1.230 -5.027 4.306 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 4 . 570 . 1 1 9 LEU CG C 0.253 -4.015 3.723 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 4 . 571 . 1 1 9 LEU H H 0.340 -3.650 0.765 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 4 . 572 . 1 1 9 LEU HA H 0.219 -6.274 1.951 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 4 . 573 . 1 1 9 LEU HB2 H -1.465 -4.030 2.572 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 574 . 1 1 9 LEU HB3 H -1.283 -5.377 3.476 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 575 . 1 1 9 LEU HD11 H -0.925 -3.799 5.424 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 4 . 576 . 1 1 9 LEU HD12 H 0.319 -2.742 5.366 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 4 . 577 . 1 1 9 LEU HD13 H -0.997 -2.508 4.427 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 4 . 578 . 1 1 9 LEU HD21 H 1.670 -5.523 3.558 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 4 . 579 . 1 1 9 LEU HD22 H 1.926 -4.564 4.854 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 4 . 580 . 1 1 9 LEU HD23 H 0.727 -5.671 4.882 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 4 . 581 . 1 1 9 LEU HG H 0.785 -3.408 3.132 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 4 . 582 . 1 1 9 LEU N N 0.562 -4.621 0.857 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 4 . 583 . 1 1 9 LEU O O -1.795 -7.165 0.814 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 4 . 584 . 1 1 10 MET C C -2.959 -5.253 -2.173 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 4 . 585 . 1 1 10 MET CA C -3.301 -5.392 -0.693 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 4 . 586 . 1 1 10 MET CB C -4.495 -4.500 -0.347 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 4 . 587 . 1 1 10 MET CE C -7.034 -5.150 2.556 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 4 . 588 . 1 1 10 MET CG C -4.768 -4.402 1.145 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 4 . 589 . 1 1 10 MET H H -1.858 -4.095 0.192 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 4 . 590 . 1 1 10 MET HA H -3.529 -6.350 -0.521 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 4 . 591 . 1 1 10 MET HB2 H -4.315 -3.580 -0.696 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 4 . 592 . 1 1 10 MET HB3 H -5.309 -4.873 -0.793 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 4 . 593 . 1 1 10 MET HE1 H -7.006 -6.009 2.046 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 4 . 594 . 1 1 10 MET HE2 H -6.446 -5.221 3.362 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 4 . 595 . 1 1 10 MET HE3 H -7.973 -4.964 2.844 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 4 . 596 . 1 1 10 MET HG2 H -4.642 -5.308 1.548 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 4 . 597 . 1 1 10 MET HG3 H -4.109 -3.765 1.544 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 4 . 598 . 1 1 10 MET N N -2.154 -5.049 0.139 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 4 . 599 . 1 1 10 MET O O -3.212 -4.216 -2.784 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 4 . 600 . 1 1 10 MET SD S -6.437 -3.825 1.509 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 5 . 601 . 1 1 1 GLY C C -1.531 8.680 -2.850 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 5 . 602 . 1 1 1 GLY CA C -2.517 8.787 -3.995 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 5 . 603 . 1 1 1 GLY H1 H -1.157 8.948 -5.479 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 5 . 604 . 1 1 1 GLY H2 H -2.639 9.504 -5.879 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 5 . 605 . 1 1 1 GLY H3 H -1.675 10.384 -4.899 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 5 . 606 . 1 1 1 GLY HA2 H -3.316 9.302 -3.684 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 5 . 607 . 1 1 1 GLY HA3 H -2.798 7.866 -4.264 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 5 . 608 . 1 1 1 GLY N N -1.953 9.458 -5.153 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 5 . 609 . 1 1 1 GLY O O -0.435 8.147 -3.015 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 5 . 610 . 1 1 2 ASN C C -1.170 7.802 0.201 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 5 . 611 . 1 1 2 ASN CA C -1.061 9.149 -0.508 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 5 . 612 . 1 1 2 ASN CB C -1.430 10.278 0.457 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 5 . 613 . 1 1 2 ASN CG C -0.316 10.586 1.439 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 5 . 614 . 1 1 2 ASN H H -2.824 9.610 -1.616 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 5 . 615 . 1 1 2 ASN HA H -0.119 9.229 -0.834 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 5 . 616 . 1 1 2 ASN HB2 H -1.628 11.102 -0.074 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 617 . 1 1 2 ASN HB3 H -2.245 10.008 0.970 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 618 . 1 1 2 ASN HD21 H -0.683 8.875 2.453 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 5 . 619 . 1 1 2 ASN HD22 H 0.606 9.847 3.080 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 5 . 620 . 1 1 2 ASN N N -1.920 9.189 -1.686 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 5 . 621 . 1 1 2 ASN ND2 N -0.114 9.696 2.404 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 5 . 622 . 1 1 2 ASN O O -1.686 7.716 1.316 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 5 . 623 . 1 1 2 ASN OD1 O 0.355 11.614 1.331 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 5 . 624 . 1 1 3 HIS C C 0.026 4.422 -0.773 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 5 . 625 . 1 1 3 HIS CA C -0.725 5.410 0.114 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 5 . 626 . 1 1 3 HIS CB C -2.171 4.954 0.293 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 5 . 627 . 1 1 3 HIS CD2 C -1.511 3.050 1.930 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 5 . 628 . 1 1 3 HIS CE1 C -3.391 2.952 3.049 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 5 . 629 . 1 1 3 HIS CG C -2.367 3.979 1.421 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 5 . 630 . 1 1 3 HIS H H -0.278 6.889 -1.358 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 5 . 631 . 1 1 3 HIS HA H -0.270 5.435 1.004 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 5 . 632 . 1 1 3 HIS HB2 H -2.737 5.759 0.473 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 633 . 1 1 3 HIS HB3 H -2.472 4.517 -0.555 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 634 . 1 1 3 HIS HD2 H -0.579 2.866 1.618 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 5 . 635 . 1 1 3 HIS HE1 H -4.087 2.677 3.712 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 5 . 636 . 1 1 3 HIS HE2 H -1.831 1.673 3.546 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 5 . 637 . 1 1 3 HIS N N -0.683 6.754 -0.454 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 5 . 638 . 1 1 3 HIS ND1 N -3.549 3.902 2.140 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 5 . 639 . 1 1 3 HIS NE2 N -2.174 2.408 2.961 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 5 . 640 . 1 1 3 HIS O O -0.446 4.057 -1.850 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 5 . 641 . 1 1 4 TRP C C 1.973 1.664 -0.426 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 5 . 642 . 1 1 4 TRP CA C 2.011 3.047 -1.067 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 5 . 643 . 1 1 4 TRP CB C 3.456 3.543 -1.152 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 5 . 644 . 1 1 4 TRP CD1 C 4.663 3.082 -3.365 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 5 . 645 . 1 1 4 TRP CD2 C 4.899 1.465 -1.834 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 5 . 646 . 1 1 4 TRP CE2 C 5.605 1.091 -2.994 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 5 . 647 . 1 1 4 TRP CE3 C 4.905 0.601 -0.735 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 5 . 648 . 1 1 4 TRP CG C 4.305 2.741 -2.092 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 5 . 649 . 1 1 4 TRP CH2 C 6.295 -0.935 -1.994 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 5 . 650 . 1 1 4 TRP CZ2 C 6.307 -0.109 -3.084 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 5 . 651 . 1 1 4 TRP CZ3 C 5.602 -0.589 -0.826 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 5 . 652 . 1 1 4 TRP H H 1.525 4.327 0.568 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 5 . 653 . 1 1 4 TRP HA H 1.608 2.964 -1.979 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 5 . 654 . 1 1 4 TRP HB2 H 3.450 4.493 -1.465 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 655 . 1 1 4 TRP HB3 H 3.864 3.496 -0.240 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 656 . 1 1 4 TRP HD1 H 4.396 3.926 -3.830 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 5 . 657 . 1 1 4 TRP HE1 H 5.835 2.103 -4.835 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 5 . 658 . 1 1 4 TRP HE3 H 4.414 0.839 0.103 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 5 . 659 . 1 1 4 TRP HH2 H 6.790 -1.804 -2.028 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 5 . 660 . 1 1 4 TRP HZ2 H 6.801 -0.354 -3.918 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 5 . 661 . 1 1 4 TRP HZ3 H 5.611 -1.213 -0.045 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 5 . 662 . 1 1 4 TRP N N 1.195 3.993 -0.315 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 5 . 663 . 1 1 4 TRP NE1 N 5.445 2.094 -3.914 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 5 . 664 . 1 1 4 TRP O O 2.002 0.648 -1.120 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 5 . 665 . 1 1 5 ALA C C 0.692 -0.490 1.169 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 5 . 666 . 1 1 5 ALA CA C 1.858 0.374 1.634 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 5 . 667 . 1 1 5 ALA CB C 1.759 0.637 3.129 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 5 . 668 . 1 1 5 ALA H H 1.883 2.494 1.409 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 5 . 669 . 1 1 5 ALA HA H 2.708 -0.124 1.459 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 5 . 670 . 1 1 5 ALA HB1 H 0.927 1.159 3.319 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 5 . 671 . 1 1 5 ALA HB2 H 1.728 -0.231 3.624 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 672 . 1 1 5 ALA HB3 H 2.557 1.162 3.426 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 673 . 1 1 5 ALA N N 1.904 1.633 0.901 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 5 . 674 . 1 1 5 ALA O O 0.731 -1.716 1.277 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 5 . 675 . 1 1 6 VAL C C -1.158 -1.553 -0.922 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 5 . 676 . 1 1 6 VAL CA C -1.528 -0.554 0.166 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 5 . 677 . 1 1 6 VAL CB C -2.583 0.422 -0.382 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 5 . 678 . 1 1 6 VAL CG1 C -1.997 1.273 -1.499 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 5 . 679 . 1 1 6 VAL CG2 C -3.808 -0.337 -0.867 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 5 . 680 . 1 1 6 VAL H H -0.319 1.155 0.589 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 5 . 681 . 1 1 6 VAL HA H -1.910 -1.068 0.934 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 5 . 682 . 1 1 6 VAL HB H -2.842 1.038 0.362 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 5 . 683 . 1 1 6 VAL HG11 H -1.689 0.686 -2.247 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 5 . 684 . 1 1 6 VAL HG12 H -2.705 1.895 -1.833 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 5 . 685 . 1 1 6 VAL HG13 H -1.224 1.804 -1.152 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 5 . 686 . 1 1 6 VAL HG21 H -4.208 -0.851 -0.108 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 5 . 687 . 1 1 6 VAL HG22 H -4.479 0.316 -1.218 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 5 . 688 . 1 1 6 VAL HG23 H -3.546 -0.969 -1.596 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 5 . 689 . 1 1 6 VAL N N -0.347 0.157 0.650 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 5 . 690 . 1 1 6 VAL O O -1.737 -2.635 -1.009 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 5 . 691 . 1 1 7 GLY C C 1.019 -3.257 -2.325 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 5 . 692 . 1 1 7 GLY CA C 0.240 -2.058 -2.830 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 5 . 693 . 1 1 7 GLY H H 0.249 -0.292 -1.640 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 5 . 694 . 1 1 7 GLY HA2 H -0.568 -2.384 -3.321 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 5 . 695 . 1 1 7 GLY HA3 H 0.822 -1.537 -3.455 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 5 . 696 . 1 1 7 GLY N N -0.189 -1.184 -1.756 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 5 . 697 . 1 1 7 GLY O O 1.139 -4.266 -3.020 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 5 . 698 . 1 1 8 HIS C C 1.422 -5.157 0.296 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 5 . 699 . 1 1 8 HIS CA C 2.324 -4.230 -0.515 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 5 . 700 . 1 1 8 HIS CB C 3.428 -3.666 0.380 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 5 . 701 . 1 1 8 HIS CD2 C 4.272 -5.217 2.285 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 5 . 702 . 1 1 8 HIS CE1 C 5.844 -6.244 1.161 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 5 . 703 . 1 1 8 HIS CG C 4.288 -4.725 1.014 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 5 . 704 . 1 1 8 HIS H H 1.420 -2.300 -0.596 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 5 . 705 . 1 1 8 HIS HA H 2.733 -4.765 -1.255 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 5 . 706 . 1 1 8 HIS HB2 H 4.014 -3.074 -0.173 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 707 . 1 1 8 HIS HB3 H 3.003 -3.128 1.108 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 708 . 1 1 8 HIS HD2 H 3.659 -4.937 3.024 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 5 . 709 . 1 1 8 HIS HE1 H 6.598 -6.859 0.930 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 5 . 710 . 1 1 8 HIS HE2 H 5.520 -6.734 3.151 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 5 . 711 . 1 1 8 HIS N N 1.552 -3.147 -1.112 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 5 . 712 . 1 1 8 HIS ND1 N 5.287 -5.386 0.319 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 5 . 713 . 1 1 8 HIS NE2 N 5.264 -6.178 2.360 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 5 . 714 . 1 1 8 HIS O O 1.602 -6.375 0.290 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 5 . 715 . 1 1 9 LEU C C -1.665 -5.817 0.981 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 5 . 716 . 1 1 9 LEU CA C -0.475 -5.344 1.810 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 5 . 717 . 1 1 9 LEU CB C -0.964 -4.507 2.992 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 5 . 718 . 1 1 9 LEU CD1 C -0.455 -2.644 4.591 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 5 . 719 . 1 1 9 LEU CD2 C 0.767 -4.819 4.779 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 5 . 720 . 1 1 9 LEU CG C 0.123 -3.824 3.825 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 5 . 721 . 1 1 9 LEU H H 0.362 -3.577 0.957 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 5 . 722 . 1 1 9 LEU HA H 0.006 -6.150 2.154 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 5 . 723 . 1 1 9 LEU HB2 H -1.568 -3.794 2.635 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 724 . 1 1 9 LEU HB3 H -1.482 -5.108 3.600 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 725 . 1 1 9 LEU HD11 H -0.834 -1.980 3.946 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 5 . 726 . 1 1 9 LEU HD12 H -1.178 -2.965 5.203 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 5 . 727 . 1 1 9 LEU HD13 H 0.269 -2.211 5.129 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 5 . 728 . 1 1 9 LEU HD21 H 1.173 -5.563 4.248 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 5 . 729 . 1 1 9 LEU HD22 H 1.477 -4.371 5.322 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 5 . 730 . 1 1 9 LEU HD23 H 0.065 -5.188 5.388 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 5 . 731 . 1 1 9 LEU HG H 0.847 -3.499 3.216 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 5 . 732 . 1 1 9 LEU N N 0.455 -4.572 0.993 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 5 . 733 . 1 1 9 LEU O O -1.850 -7.015 0.768 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 5 . 734 . 1 1 10 MET C C -3.259 -5.339 -1.766 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 5 . 735 . 1 1 10 MET CA C -3.639 -5.186 -0.296 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 5 . 736 . 1 1 10 MET CB C -4.704 -4.099 -0.143 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 5 . 737 . 1 1 10 MET CE C -6.350 -4.599 3.658 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 5 . 738 . 1 1 10 MET CG C -5.106 -3.841 1.301 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 5 . 739 . 1 1 10 MET H H -2.264 -3.910 0.721 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 5 . 740 . 1 1 10 MET HA H -3.999 -6.064 0.019 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 5 . 741 . 1 1 10 MET HB2 H -4.346 -3.248 -0.528 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 5 . 742 . 1 1 10 MET HB3 H -5.518 -4.379 -0.652 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 5 . 743 . 1 1 10 MET HE1 H -5.550 -4.236 4.137 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 5 . 744 . 1 1 10 MET HE2 H -7.003 -3.860 3.491 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 5 . 745 . 1 1 10 MET HE3 H -6.782 -5.305 4.219 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 5 . 746 . 1 1 10 MET HG2 H -4.290 -3.567 1.811 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 5 . 747 . 1 1 10 MET HG3 H -5.772 -3.095 1.314 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 5 . 748 . 1 1 10 MET N N -2.468 -4.867 0.513 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 5 . 749 . 1 1 10 MET O O -4.120 -5.548 -2.622 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 5 . 750 . 1 1 10 MET SD S -5.832 -5.291 2.089 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 6 . 751 . 1 1 1 GLY C C -1.372 9.784 -1.388 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 6 . 752 . 1 1 1 GLY CA C -2.471 10.602 -2.035 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 6 . 753 . 1 1 1 GLY H1 H -2.211 9.921 -3.917 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 6 . 754 . 1 1 1 GLY H2 H -2.998 11.350 -3.834 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 6 . 755 . 1 1 1 GLY H3 H -1.385 11.291 -3.590 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 6 . 756 . 1 1 1 GLY HA2 H -2.514 11.494 -1.585 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 6 . 757 . 1 1 1 GLY HA3 H -3.341 10.124 -1.912 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 6 . 758 . 1 1 1 GLY N N -2.249 10.807 -3.454 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 6 . 759 . 1 1 1 GLY O O -0.453 9.323 -2.063 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 6 . 760 . 1 1 2 ASN C C -0.871 7.366 0.754 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 6 . 761 . 1 1 2 ASN CA C -0.470 8.835 0.664 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 6 . 762 . 1 1 2 ASN CB C -0.290 9.413 2.070 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 6 . 763 . 1 1 2 ASN CG C 0.439 10.743 2.060 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 6 . 764 . 1 1 2 ASN H H -2.239 10.001 0.418 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 6 . 765 . 1 1 2 ASN HA H 0.376 8.872 0.133 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 6 . 766 . 1 1 2 ASN HB2 H -1.192 9.544 2.481 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 767 . 1 1 2 ASN HB3 H 0.235 8.763 2.619 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 768 . 1 1 2 ASN HD21 H 0.032 11.024 4.021 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 6 . 769 . 1 1 2 ASN HD22 H 0.940 12.290 3.263 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 6 . 770 . 1 1 2 ASN N N -1.466 9.602 -0.075 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 6 . 771 . 1 1 2 ASN ND2 N 0.473 11.407 3.209 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 6 . 772 . 1 1 2 ASN O O -1.348 6.903 1.791 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 6 . 773 . 1 1 2 ASN OD1 O 0.965 11.167 1.031 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 6 . 774 . 1 1 3 HIS C C 0.090 4.417 -1.067 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 6 . 775 . 1 1 3 HIS CA C -1.014 5.219 -0.385 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 6 . 776 . 1 1 3 HIS CB C -2.339 5.012 -1.119 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 6 . 777 . 1 1 3 HIS CD2 C -3.914 4.089 0.728 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 6 . 778 . 1 1 3 HIS CE1 C -5.402 5.695 0.683 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 6 . 779 . 1 1 3 HIS CG C -3.539 5.002 -0.212 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 6 . 780 . 1 1 3 HIS H H -0.286 7.071 -1.152 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 6 . 781 . 1 1 3 HIS HA H -1.100 4.890 0.556 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 6 . 782 . 1 1 3 HIS HB2 H -2.453 5.752 -1.782 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 783 . 1 1 3 HIS HB3 H -2.302 4.136 -1.600 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 784 . 1 1 3 HIS HD2 H -3.427 3.249 0.969 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 6 . 785 . 1 1 3 HIS HE1 H -6.211 6.245 0.891 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 6 . 786 . 1 1 3 HIS HE2 H -5.639 4.110 2.006 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 6 . 787 . 1 1 3 HIS N N -0.675 6.637 -0.340 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 6 . 788 . 1 1 3 HIS ND1 N -4.490 6.008 -0.226 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 6 . 789 . 1 1 3 HIS NE2 N -5.096 4.543 1.286 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 6 . 790 . 1 1 3 HIS O O 0.077 4.239 -2.286 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 6 . 791 . 1 1 4 TRP C C 2.093 1.716 -0.304 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 6 . 792 . 1 1 4 TRP CA C 2.153 3.155 -0.805 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 6 . 793 . 1 1 4 TRP CB C 3.485 3.792 -0.409 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 6 . 794 . 1 1 4 TRP CD1 C 5.289 3.958 -2.222 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 6 . 795 . 1 1 4 TRP CD2 C 5.298 2.026 -1.089 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 6 . 796 . 1 1 4 TRP CE2 C 6.329 1.989 -2.048 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 6 . 797 . 1 1 4 TRP CE3 C 5.112 0.918 -0.257 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 6 . 798 . 1 1 4 TRP CG C 4.645 3.294 -1.217 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 6 . 799 . 1 1 4 TRP CH2 C 6.964 -0.182 -1.369 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 6 . 800 . 1 1 4 TRP CZ2 C 7.168 0.888 -2.197 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 6 . 801 . 1 1 4 TRP CZ3 C 5.947 -0.174 -0.406 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 6 . 802 . 1 1 4 TRP H H 0.994 4.116 0.707 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 6 . 803 . 1 1 4 TRP HA H 2.053 3.129 -1.800 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 6 . 804 . 1 1 4 TRP HB2 H 3.415 4.782 -0.534 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 805 . 1 1 4 TRP HB3 H 3.662 3.590 0.554 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 806 . 1 1 4 TRP HD1 H 5.058 4.876 -2.544 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 6 . 807 . 1 1 4 TRP HE1 H 6.921 3.435 -3.470 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 6 . 808 . 1 1 4 TRP HE3 H 4.389 0.914 0.434 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 6 . 809 . 1 1 4 TRP HH2 H 7.551 -0.987 -1.451 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 6 . 810 . 1 1 4 TRP HZ2 H 7.893 0.884 -2.886 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 6 . 811 . 1 1 4 TRP HZ3 H 5.822 -0.971 0.184 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 6 . 812 . 1 1 4 TRP N N 1.041 3.937 -0.276 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 6 . 813 . 1 1 4 TRP NE1 N 6.302 3.178 -2.727 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 6 . 814 . 1 1 4 TRP O O 2.112 0.772 -1.094 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 6 . 815 . 1 1 5 ALA C C 0.726 -0.531 1.142 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 6 . 816 . 1 1 5 ALA CA C 1.957 0.232 1.619 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 6 . 817 . 1 1 5 ALA CB C 1.954 0.345 3.137 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 6 . 818 . 1 1 5 ALA H H 2.011 2.362 1.604 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 6 . 819 . 1 1 5 ALA HA H 2.771 -0.280 1.344 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 6 . 820 . 1 1 5 ALA HB1 H 1.160 0.878 3.427 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 6 . 821 . 1 1 5 ALA HB2 H 1.910 -0.567 3.544 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 822 . 1 1 5 ALA HB3 H 2.791 0.804 3.436 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 823 . 1 1 5 ALA N N 2.021 1.555 1.014 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 6 . 824 . 1 1 5 ALA O O 0.708 -1.762 1.140 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 6 . 825 . 1 1 6 VAL C C -1.265 -1.357 -0.899 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 6 . 826 . 1 1 6 VAL CA C -1.538 -0.400 0.255 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 6 . 827 . 1 1 6 VAL CB C -2.546 0.669 -0.202 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 6 . 828 . 1 1 6 VAL CG1 C -1.975 1.485 -1.352 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 6 . 829 . 1 1 6 VAL CG2 C -3.864 0.021 -0.602 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 6 . 830 . 1 1 6 VAL H H -0.227 1.205 0.763 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 6 . 831 . 1 1 6 VAL HA H -1.928 -0.933 1.006 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 6 . 832 . 1 1 6 VAL HB H -2.696 1.292 0.565 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 6 . 833 . 1 1 6 VAL HG11 H -1.774 0.886 -2.127 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 6 . 834 . 1 1 6 VAL HG12 H -2.651 2.169 -1.626 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 6 . 835 . 1 1 6 VAL HG13 H -1.136 1.944 -1.059 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 6 . 836 . 1 1 6 VAL HG21 H -4.248 -0.470 0.179 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 6 . 837 . 1 1 6 VAL HG22 H -4.502 0.733 -0.895 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 6 . 838 . 1 1 6 VAL HG23 H -3.710 -0.619 -1.355 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 6 . 839 . 1 1 6 VAL N N -0.302 0.208 0.737 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 6 . 840 . 1 1 6 VAL O O -2.033 -2.287 -1.143 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 6 . 841 . 1 1 7 GLY C C 0.965 -3.199 -2.307 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 6 . 842 . 1 1 7 GLY CA C 0.187 -1.970 -2.732 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 6 . 843 . 1 1 7 GLY H H 0.421 -0.351 -1.367 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 6 . 844 . 1 1 7 GLY HA2 H -0.652 -2.264 -3.190 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 6 . 845 . 1 1 7 GLY HA3 H 0.747 -1.440 -3.369 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 6 . 846 . 1 1 7 GLY N N -0.168 -1.122 -1.609 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 6 . 847 . 1 1 7 GLY O O 1.034 -4.185 -3.041 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 6 . 848 . 1 1 8 HIS C C 1.429 -5.272 0.102 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 6 . 849 . 1 1 8 HIS CA C 2.333 -4.259 -0.594 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 6 . 850 . 1 1 8 HIS CB C 3.398 -3.755 0.381 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 6 . 851 . 1 1 8 HIS CD2 C 4.285 -5.097 2.420 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 6 . 852 . 1 1 8 HIS CE1 C 5.337 -6.664 1.313 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 6 . 853 . 1 1 8 HIS CG C 4.134 -4.861 1.087 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 6 . 854 . 1 1 8 HIS H H 1.460 -2.313 -0.565 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 6 . 855 . 1 1 8 HIS HA H 2.775 -4.717 -1.365 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 6 . 856 . 1 1 8 HIS HB2 H 4.063 -3.209 -0.128 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 857 . 1 1 8 HIS HB3 H 2.954 -3.182 1.070 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 858 . 1 1 8 HIS HD2 H 3.914 -4.546 3.167 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 6 . 859 . 1 1 8 HIS HE1 H 5.881 -7.477 1.106 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 6 . 860 . 1 1 8 HIS HE2 H 5.345 -6.691 3.388 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 6 . 861 . 1 1 8 HIS N N 1.554 -3.142 -1.116 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 6 . 862 . 1 1 8 HIS ND1 N 4.806 -5.861 0.404 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 6 . 863 . 1 1 8 HIS NE2 N 5.049 -6.242 2.545 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 6 . 864 . 1 1 8 HIS O O 1.597 -6.482 -0.056 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 6 . 865 . 1 1 9 LEU C C -1.550 -6.154 0.670 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 6 . 866 . 1 1 9 LEU CA C -0.458 -5.632 1.598 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 6 . 867 . 1 1 9 LEU CB C -1.086 -4.869 2.767 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 6 . 868 . 1 1 9 LEU CD1 C -0.853 -3.008 4.429 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 6 . 869 . 1 1 9 LEU CD2 C 0.588 -5.044 4.624 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 6 . 870 . 1 1 9 LEU CG C -0.118 -4.098 3.663 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 6 . 871 . 1 1 9 LEU H H 0.387 -3.779 0.966 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 6 . 872 . 1 1 9 LEU HA H 0.052 -6.416 1.952 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 6 . 873 . 1 1 9 LEU HB2 H -1.740 -4.214 2.389 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 874 . 1 1 9 LEU HB3 H -1.571 -5.530 3.339 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 875 . 1 1 9 LEU HD11 H -1.273 -2.371 3.783 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 6 . 876 . 1 1 9 LEU HD12 H -1.563 -3.421 4.999 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 6 . 877 . 1 1 9 LEU HD13 H -0.205 -2.515 5.009 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 6 . 878 . 1 1 9 LEU HD21 H 1.095 -5.726 4.096 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 6 . 879 . 1 1 9 LEU HD22 H 1.221 -4.538 5.210 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 6 . 880 . 1 1 9 LEU HD23 H -0.096 -5.503 5.191 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 6 . 881 . 1 1 9 LEU HG H 0.592 -3.680 3.096 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 6 . 882 . 1 1 9 LEU N N 0.472 -4.771 0.876 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 6 . 883 . 1 1 9 LEU O O -1.675 -7.360 0.460 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 6 . 884 . 1 1 10 MET C C -3.038 -5.297 -2.239 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 6 . 885 . 1 1 10 MET CA C -3.416 -5.605 -0.793 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 6 . 886 . 1 1 10 MET CB C -4.700 -4.863 -0.420 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 6 . 887 . 1 1 10 MET CE C -6.862 -6.371 2.763 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 6 . 888 . 1 1 10 MET CG C -5.134 -5.085 1.020 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 6 . 889 . 1 1 10 MET H H -2.184 -4.271 0.327 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 6 . 890 . 1 1 10 MET HA H -3.556 -6.592 -0.717 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 6 . 891 . 1 1 10 MET HB2 H -4.552 -3.884 -0.557 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 6 . 892 . 1 1 10 MET HB3 H -5.434 -5.177 -1.023 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 6 . 893 . 1 1 10 MET HE1 H -6.232 -6.115 3.496 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 6 . 894 . 1 1 10 MET HE2 H -7.504 -5.622 2.598 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 6 . 895 . 1 1 10 MET HE3 H -7.368 -7.191 3.030 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 6 . 896 . 1 1 10 MET HG2 H -4.325 -5.029 1.604 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 6 . 897 . 1 1 10 MET HG3 H -5.776 -4.360 1.270 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 6 . 898 . 1 1 10 MET N N -2.336 -5.236 0.116 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 6 . 899 . 1 1 10 MET O O -1.918 -4.869 -2.521 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 6 . 900 . 1 1 10 MET SD S -5.928 -6.684 1.268 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 7 . 901 . 1 1 1 GLY C C -0.785 8.800 -2.843 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 7 . 902 . 1 1 1 GLY CA C -1.515 8.779 -4.171 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 7 . 903 . 1 1 1 GLY H1 H -0.109 7.772 -5.212 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 7 . 904 . 1 1 1 GLY H2 H -1.142 8.623 -6.148 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 7 . 905 . 1 1 1 GLY H3 H 0.030 9.396 -5.314 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 7 . 906 . 1 1 1 GLY HA2 H -2.019 9.637 -4.274 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 7 . 907 . 1 1 1 GLY HA3 H -2.158 8.013 -4.172 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 7 . 908 . 1 1 1 GLY N N -0.614 8.631 -5.299 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 7 . 909 . 1 1 1 GLY O O 0.428 8.605 -2.792 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 7 . 910 . 1 1 2 ASN C C -1.064 7.737 0.266 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 7 . 911 . 1 1 2 ASN CA C -0.941 9.088 -0.432 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 7 . 912 . 1 1 2 ASN CB C -1.621 10.171 0.407 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 7 . 913 . 1 1 2 ASN CG C -1.124 11.563 0.068 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 7 . 914 . 1 1 2 ASN H H -2.509 9.189 -1.873 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 7 . 915 . 1 1 2 ASN HA H 0.036 9.264 -0.551 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 7 . 916 . 1 1 2 ASN HB2 H -2.607 10.133 0.242 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 917 . 1 1 2 ASN HB3 H -1.437 9.991 1.373 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 918 . 1 1 2 ASN HD21 H -2.825 12.390 0.784 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 7 . 919 . 1 1 2 ASN HD22 H -1.661 13.511 0.161 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 7 . 920 . 1 1 2 ASN N N -1.526 9.039 -1.766 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 7 . 921 . 1 1 2 ASN ND2 N -1.937 12.571 0.362 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 7 . 922 . 1 1 2 ASN O O -1.471 7.660 1.426 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 7 . 923 . 1 1 2 ASN OD1 O -0.020 11.730 -0.452 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 7 . 924 . 1 1 3 HIS C C 0.001 4.342 -0.767 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 7 . 925 . 1 1 3 HIS CA C -0.778 5.324 0.103 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 7 . 926 . 1 1 3 HIS CB C -2.233 4.873 0.223 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 7 . 927 . 1 1 3 HIS CD2 C -1.682 3.051 1.989 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 7 . 928 . 1 1 3 HIS CE1 C -3.605 3.057 3.036 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 7 . 929 . 1 1 3 HIS CG C -2.496 3.968 1.394 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 7 . 930 . 1 1 3 HIS H H -0.387 6.801 -1.386 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 7 . 931 . 1 1 3 HIS HA H -0.356 5.337 1.010 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 7 . 932 . 1 1 3 HIS HB2 H -2.809 5.685 0.319 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 933 . 1 1 3 HIS HB3 H -2.483 4.384 -0.613 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 934 . 1 1 3 HIS HD2 H -0.743 2.830 1.726 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 7 . 935 . 1 1 3 HIS HE1 H -4.332 2.836 3.686 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 7 . 936 . 1 1 3 HIS HE2 H -2.096 1.774 3.663 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 7 . 937 . 1 1 3 HIS N N -0.709 6.673 -0.448 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 7 . 938 . 1 1 3 HIS ND1 N -3.706 3.957 2.069 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 7 . 939 . 1 1 3 HIS NE2 N -2.399 2.483 3.026 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 7 . 940 . 1 1 3 HIS O O -0.490 3.891 -1.802 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 7 . 941 . 1 1 4 TRP C C 2.037 1.702 -0.443 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 7 . 942 . 1 1 4 TRP CA C 2.062 3.087 -1.079 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 7 . 943 . 1 1 4 TRP CB C 3.498 3.610 -1.137 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 7 . 944 . 1 1 4 TRP CD1 C 4.716 3.022 -3.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 7 . 945 . 1 1 4 TRP CD2 C 5.086 1.587 -1.634 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 7 . 946 . 1 1 4 TRP CE2 C 5.808 1.153 -2.764 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 7 . 947 . 1 1 4 TRP CE3 C 5.167 0.840 -0.456 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 7 . 948 . 1 1 4 TRP CG C 4.396 2.784 -2.008 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 7 . 949 . 1 1 4 TRP CH2 C 6.657 -0.706 -1.579 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 7 . 950 . 1 1 4 TRP CZ2 C 6.597 0.006 -2.747 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 7 . 951 . 1 1 4 TRP CZ3 C 5.950 -0.298 -0.441 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 7 . 952 . 1 1 4 TRP H H 1.557 4.415 0.512 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 7 . 953 . 1 1 4 TRP HA H 1.678 3.000 -1.998 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 7 . 954 . 1 1 4 TRP HB2 H 3.484 4.544 -1.495 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 955 . 1 1 4 TRP HB3 H 3.874 3.614 -0.210 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 956 . 1 1 4 TRP HD1 H 4.382 3.794 -3.856 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 7 . 957 . 1 1 4 TRP HE1 H 5.945 1.989 -4.698 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 7 . 958 . 1 1 4 TRP HE3 H 4.667 1.123 0.363 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 7 . 959 . 1 1 4 TRP HH2 H 7.216 -1.534 -1.535 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 7 . 960 . 1 1 4 TRP HZ2 H 7.100 -0.284 -3.561 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 7 . 961 . 1 1 4 TRP HZ3 H 6.012 -0.839 0.398 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 7 . 962 . 1 1 4 TRP N N 1.215 4.015 -0.339 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 7 . 963 . 1 1 4 TRP NE1 N 5.565 2.044 -3.775 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 7 . 964 . 1 1 4 TRP O O 2.139 0.690 -1.134 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 7 . 965 . 1 1 5 ALA C C 0.691 -0.460 1.147 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 7 . 966 . 1 1 5 ALA CA C 1.860 0.404 1.608 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 7 . 967 . 1 1 5 ALA CB C 1.770 0.662 3.105 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 7 . 968 . 1 1 5 ALA H H 1.825 2.524 1.386 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 7 . 969 . 1 1 5 ALA HA H 2.709 -0.093 1.427 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 7 . 970 . 1 1 5 ALA HB1 H 0.939 1.183 3.302 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 7 . 971 . 1 1 5 ALA HB2 H 1.742 -0.208 3.597 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 972 . 1 1 5 ALA HB3 H 2.569 1.186 3.399 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 973 . 1 1 5 ALA N N 1.901 1.665 0.879 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 7 . 974 . 1 1 5 ALA O O 0.743 -1.687 1.226 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 7 . 975 . 1 1 6 VAL C C -1.194 -1.481 -0.936 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 7 . 976 . 1 1 6 VAL CA C -1.548 -0.519 0.191 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 7 . 977 . 1 1 6 VAL CB C -2.627 0.460 -0.302 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 7 . 978 . 1 1 6 VAL CG1 C -2.126 1.247 -1.504 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 7 . 979 . 1 1 6 VAL CG2 C -3.909 -0.286 -0.641 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 7 . 980 . 1 1 6 VAL H H -0.348 1.189 0.629 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 7 . 981 . 1 1 6 VAL HA H -1.905 -1.060 0.952 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 7 . 982 . 1 1 6 VAL HB H -2.804 1.113 0.434 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 7 . 983 . 1 1 6 VAL HG11 H -1.313 1.771 -1.252 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 7 . 984 . 1 1 6 VAL HG12 H -1.901 0.621 -2.250 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 7 . 985 . 1 1 6 VAL HG13 H -2.847 1.873 -1.800 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 7 . 986 . 1 1 6 VAL HG21 H -4.250 -0.757 0.173 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 7 . 987 . 1 1 6 VAL HG22 H -4.594 0.369 -0.958 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 7 . 988 . 1 1 6 VAL HG23 H -3.728 -0.955 -1.362 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 7 . 989 . 1 1 6 VAL N N -0.365 0.190 0.666 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 7 . 990 . 1 1 6 VAL O O -1.864 -2.495 -1.133 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 7 . 991 . 1 1 7 GLY C C 1.034 -3.235 -2.306 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 7 . 992 . 1 1 7 GLY CA C 0.284 -2.004 -2.776 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 7 . 993 . 1 1 7 GLY H H 0.368 -0.321 -1.473 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 7 . 994 . 1 1 7 GLY HA2 H -0.525 -2.296 -3.286 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 7 . 995 . 1 1 7 GLY HA3 H 0.882 -1.473 -3.376 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 7 . 996 . 1 1 7 GLY N N -0.140 -1.158 -1.676 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 7 . 997 . 1 1 7 GLY O O 1.137 -4.224 -3.032 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 7 . 998 . 1 1 8 HIS C C 1.373 -5.252 0.215 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 7 . 999 . 1 1 8 HIS CA C 2.306 -4.294 -0.519 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 7 . 1000 . 1 1 8 HIS CB C 3.384 -3.782 0.437 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 7 . 1001 . 1 1 8 HIS CD2 C 3.962 -5.377 2.403 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 7 . 1002 . 1 1 8 HIS CE1 C 5.595 -6.467 1.435 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 7 . 1003 . 1 1 8 HIS CG C 4.128 -4.881 1.145 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 7 . 1004 . 1 1 8 HIS H H 1.442 -2.343 -0.544 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 7 . 1005 . 1 1 8 HIS HA H 2.735 -4.794 -1.271 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 7 . 1006 . 1 1 8 HIS HB2 H 4.043 -3.242 -0.086 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 1007 . 1 1 8 HIS HB3 H 2.949 -3.201 1.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 1008 . 1 1 8 HIS HD2 H 3.290 -5.073 3.078 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 7 . 1009 . 1 1 8 HIS HE1 H 6.341 -7.114 1.276 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 7 . 1010 . 1 1 8 HIS HE2 H 5.048 -6.950 3.380 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 7 . 1011 . 1 1 8 HIS N N 1.560 -3.175 -1.086 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 7 . 1012 . 1 1 8 HIS ND1 N 5.164 -5.581 0.549 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 7 . 1013 . 1 1 8 HIS NE2 N 4.899 -6.381 2.571 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 7 . 1014 . 1 1 8 HIS O O 1.560 -6.469 0.177 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 7 . 1015 . 1 1 9 LEU C C -1.720 -5.983 0.717 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 7 . 1016 . 1 1 9 LEU CA C -0.594 -5.501 1.627 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 7 . 1017 . 1 1 9 LEU CB C -1.173 -4.693 2.790 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 7 . 1018 . 1 1 9 LEU CD1 C -0.848 -2.920 4.531 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 7 . 1019 . 1 1 9 LEU CD2 C 0.586 -4.970 4.556 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 7 . 1020 . 1 1 9 LEU CG C -0.158 -3.973 3.678 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 7 . 1021 . 1 1 9 LEU H H 0.269 -3.701 0.875 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 7 . 1022 . 1 1 9 LEU HA H -0.118 -6.303 1.987 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 7 . 1023 . 1 1 9 LEU HB2 H -1.788 -4.003 2.408 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 1024 . 1 1 9 LEU HB3 H -1.695 -5.320 3.369 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 1025 . 1 1 9 LEU HD11 H -1.293 -2.249 3.938 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 7 . 1026 . 1 1 9 LEU HD12 H -1.534 -3.358 5.112 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 7 . 1027 . 1 1 9 LEU HD13 H -0.170 -2.460 5.104 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 7 . 1028 . 1 1 9 LEU HD21 H -0.074 -5.454 5.131 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 7 . 1029 . 1 1 9 LEU HD22 H 1.063 -5.626 3.971 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 7 . 1030 . 1 1 9 LEU HD23 H 1.249 -4.497 5.136 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 7 . 1031 . 1 1 9 LEU HG H 0.528 -3.531 3.100 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 7 . 1032 . 1 1 9 LEU N N 0.368 -4.696 0.883 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 7 . 1033 . 1 1 9 LEU O O -1.934 -7.185 0.562 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 7 . 1034 . 1 1 10 MET C C -3.049 -5.476 -2.221 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 7 . 1035 . 1 1 10 MET CA C -3.537 -5.365 -0.779 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 7 . 1036 . 1 1 10 MET CB C -4.637 -4.307 -0.680 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 7 . 1037 . 1 1 10 MET CE C -6.484 -2.453 2.554 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 7 . 1038 . 1 1 10 MET CG C -5.037 -3.978 0.749 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 7 . 1039 . 1 1 10 MET H H -2.212 -4.077 0.286 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 7 . 1040 . 1 1 10 MET HA H -3.897 -6.258 -0.508 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 7 . 1041 . 1 1 10 MET HB2 H -4.311 -3.469 -1.117 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 7 . 1042 . 1 1 10 MET HB3 H -5.445 -4.643 -1.164 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 7 . 1043 . 1 1 10 MET HE1 H -6.514 -3.265 3.137 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 7 . 1044 . 1 1 10 MET HE2 H -5.638 -1.949 2.728 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 7 . 1045 . 1 1 10 MET HE3 H -7.269 -1.867 2.757 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 7 . 1046 . 1 1 10 MET HG2 H -5.200 -4.836 1.236 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 7 . 1047 . 1 1 10 MET HG3 H -4.281 -3.488 1.183 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 7 . 1048 . 1 1 10 MET N N -2.435 -5.037 0.118 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 7 . 1049 . 1 1 10 MET O O -2.640 -4.485 -2.827 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 7 . 1050 . 1 1 10 MET SD S -6.523 -2.961 0.837 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 8 . 1051 . 1 1 1 GLY C C -2.380 8.446 -2.580 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 8 . 1052 . 1 1 1 GLY CA C -2.577 8.273 -4.072 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 8 . 1053 . 1 1 1 GLY H1 H -3.782 6.656 -3.977 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 8 . 1054 . 1 1 1 GLY H2 H -3.048 6.848 -5.423 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 8 . 1055 . 1 1 1 GLY H3 H -2.199 6.291 -4.144 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 8 . 1056 . 1 1 1 GLY HA2 H -1.727 8.518 -4.539 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 8 . 1057 . 1 1 1 GLY HA3 H -3.310 8.883 -4.372 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 8 . 1058 . 1 1 1 GLY N N -2.929 6.911 -4.432 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 8 . 1059 . 1 1 1 GLY O O -3.279 8.157 -1.790 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 8 . 1060 . 1 1 2 ASN C C -1.010 7.822 0.001 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 8 . 1061 . 1 1 2 ASN CA C -0.887 9.125 -0.782 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 8 . 1062 . 1 1 2 ASN CB C -1.816 10.183 -0.182 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 8 . 1063 . 1 1 2 ASN CG C -1.354 10.651 1.184 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 8 . 1064 . 1 1 2 ASN H H -0.510 9.134 -2.881 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 8 . 1065 . 1 1 2 ASN HA H 0.073 9.400 -0.736 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 8 . 1066 . 1 1 2 ASN HB2 H -1.846 10.970 -0.798 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1067 . 1 1 2 ASN HB3 H -2.733 9.793 -0.095 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1068 . 1 1 2 ASN HD21 H 0.446 11.192 0.435 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 8 . 1069 . 1 1 2 ASN HD22 H 0.235 11.470 2.131 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 8 . 1070 . 1 1 2 ASN N N -1.200 8.917 -2.191 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 8 . 1071 . 1 1 2 ASN ND2 N -0.123 11.145 1.256 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 8 . 1072 . 1 1 2 ASN O O -1.482 7.810 1.138 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 8 . 1073 . 1 1 2 ASN OD1 O -2.095 10.570 2.163 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 8 . 1074 . 1 1 3 HIS C C 0.062 4.362 -0.827 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 8 . 1075 . 1 1 3 HIS CA C -0.639 5.417 0.026 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 8 . 1076 . 1 1 3 HIS CB C -2.091 5.008 0.267 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 8 . 1077 . 1 1 3 HIS CD2 C -1.439 3.112 1.917 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1078 . 1 1 3 HIS CE1 C -3.264 3.127 3.127 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1079 . 1 1 3 HIS CG C -2.277 4.069 1.426 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 8 . 1080 . 1 1 3 HIS H H -0.205 6.799 -1.539 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 8 . 1081 . 1 1 3 HIS HA H -0.159 5.477 0.901 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 8 . 1082 . 1 1 3 HIS HB2 H -2.627 5.834 0.444 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1083 . 1 1 3 HIS HB3 H -2.434 4.559 -0.558 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1084 . 1 1 3 HIS HD2 H -0.532 2.878 1.566 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1085 . 1 1 3 HIS HE1 H -3.938 2.901 3.830 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1086 . 1 1 3 HIS HE2 H -1.744 1.786 3.579 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1087 . 1 1 3 HIS N N -0.579 6.725 -0.615 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 8 . 1088 . 1 1 3 HIS ND1 N -3.424 4.063 2.203 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 8 . 1089 . 1 1 3 HIS NE2 N -2.080 2.524 2.994 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1090 . 1 1 3 HIS O O -0.453 3.946 -1.864 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 8 . 1091 . 1 1 4 TRP C C 1.967 1.588 -0.384 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 8 . 1092 . 1 1 4 TRP CA C 2.010 2.932 -1.106 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 8 . 1093 . 1 1 4 TRP CB C 3.459 3.392 -1.268 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 8 . 1094 . 1 1 4 TRP CD1 C 4.704 2.338 -3.245 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 8 . 1095 . 1 1 4 TRP CD2 C 4.951 1.236 -1.311 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1096 . 1 1 4 TRP CE2 C 5.678 0.561 -2.310 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1097 . 1 1 4 TRP CE3 C 4.958 0.727 -0.009 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 8 . 1098 . 1 1 4 TRP CG C 4.335 2.372 -1.931 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 8 . 1099 . 1 1 4 TRP CH2 C 6.394 -1.075 -0.762 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 8 . 1100 . 1 1 4 TRP CZ2 C 6.404 -0.598 -2.044 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 8 . 1101 . 1 1 4 TRP CZ3 C 5.678 -0.423 0.251 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 8 . 1102 . 1 1 4 TRP H H 1.603 4.312 0.470 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 8 . 1103 . 1 1 4 TRP HA H 1.575 2.806 -1.997 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 8 . 1104 . 1 1 4 TRP HB2 H 3.470 4.225 -1.822 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1105 . 1 1 4 TRP HB3 H 3.835 3.589 -0.362 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1106 . 1 1 4 TRP HD1 H 4.427 3.006 -3.936 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 8 . 1107 . 1 1 4 TRP HE1 H 5.915 1.004 -4.361 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1108 . 1 1 4 TRP HE3 H 4.452 1.186 0.721 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 8 . 1109 . 1 1 4 TRP HH2 H 6.906 -1.905 -0.540 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 8 . 1110 . 1 1 4 TRP HZ2 H 6.914 -1.062 -2.769 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 8 . 1111 . 1 1 4 TRP HZ3 H 5.688 -0.796 1.179 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 8 . 1112 . 1 1 4 TRP N N 1.238 3.936 -0.382 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 8 . 1113 . 1 1 4 TRP NE1 N 5.512 1.252 -3.480 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1114 . 1 1 4 TRP O O 2.067 0.534 -1.009 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 8 . 1115 . 1 1 5 ALA C C 0.596 -0.464 1.315 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 8 . 1116 . 1 1 5 ALA CA C 1.760 0.423 1.742 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 8 . 1117 . 1 1 5 ALA CB C 1.645 0.775 3.218 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 8 . 1118 . 1 1 5 ALA H H 1.744 2.526 1.387 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 8 . 1119 . 1 1 5 ALA HA H 2.610 -0.086 1.607 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 8 . 1120 . 1 1 5 ALA HB1 H 0.813 1.309 3.367 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 8 . 1121 . 1 1 5 ALA HB2 H 1.606 -0.062 3.763 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1122 . 1 1 5 ALA HB3 H 2.441 1.315 3.492 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1123 . 1 1 5 ALA N N 1.818 1.636 0.936 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 8 . 1124 . 1 1 5 ALA O O 0.628 -1.680 1.501 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 8 . 1125 . 1 1 6 VAL C C -1.264 -1.508 -0.870 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 8 . 1126 . 1 1 6 VAL CA C -1.610 -0.582 0.288 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 8 . 1127 . 1 1 6 VAL CB C -2.734 0.375 -0.147 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 8 . 1128 . 1 1 6 VAL CG1 C -2.277 1.239 -1.313 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 8 . 1129 . 1 1 6 VAL CG2 C -3.987 -0.407 -0.513 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 8 . 1130 . 1 1 6 VAL H H -0.402 1.145 0.622 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 8 . 1131 . 1 1 6 VAL HA H -1.927 -1.150 1.048 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 8 . 1132 . 1 1 6 VAL HB H -2.929 0.984 0.622 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 8 . 1133 . 1 1 6 VAL HG11 H -2.034 0.660 -2.091 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 8 . 1134 . 1 1 6 VAL HG12 H -3.026 1.848 -1.572 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 8 . 1135 . 1 1 6 VAL HG13 H -1.483 1.783 -1.042 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 8 . 1136 . 1 1 6 VAL HG21 H -4.300 -0.932 0.279 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 8 . 1137 . 1 1 6 VAL HG22 H -4.702 0.234 -0.792 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 8 . 1138 . 1 1 6 VAL HG23 H -3.786 -1.031 -1.268 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 8 . 1139 . 1 1 6 VAL N N -0.434 0.153 0.743 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 8 . 1140 . 1 1 6 VAL O O -1.912 -2.534 -1.073 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 8 . 1141 . 1 1 7 GLY C C 1.253 -2.946 -2.399 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 8 . 1142 . 1 1 7 GLY CA C 0.174 -1.947 -2.764 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 8 . 1143 . 1 1 7 GLY H H 0.252 -0.292 -1.424 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 8 . 1144 . 1 1 7 GLY HA2 H -0.621 -2.445 -3.109 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 8 . 1145 . 1 1 7 GLY HA3 H 0.525 -1.343 -3.479 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 8 . 1146 . 1 1 7 GLY N N -0.239 -1.138 -1.633 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 8 . 1147 . 1 1 7 GLY O O 1.966 -3.448 -3.268 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 8 . 1148 . 1 1 8 HIS C C 1.720 -5.350 0.098 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 8 . 1149 . 1 1 8 HIS CA C 2.379 -4.181 -0.628 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 8 . 1150 . 1 1 8 HIS CB C 3.368 -3.481 0.306 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 8 . 1151 . 1 1 8 HIS CD2 C 4.609 -4.928 2.068 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1152 . 1 1 8 HIS CE1 C 6.259 -5.601 0.795 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1153 . 1 1 8 HIS CG C 4.447 -4.389 0.827 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 8 . 1154 . 1 1 8 HIS H H 0.770 -2.793 -0.447 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 8 . 1155 . 1 1 8 HIS HA H 2.867 -4.545 -1.422 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 8 . 1156 . 1 1 8 HIS HB2 H 3.801 -2.731 -0.194 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1157 . 1 1 8 HIS HB3 H 2.862 -3.113 1.086 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1158 . 1 1 8 HIS HD2 H 4.009 -4.796 2.857 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1159 . 1 1 8 HIS HE1 H 7.094 -6.056 0.485 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1160 . 1 1 8 HIS HE2 H 6.168 -6.226 2.774 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1161 . 1 1 8 HIS N N 1.378 -3.235 -1.107 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 8 . 1162 . 1 1 8 HIS ND1 N 5.498 -4.826 0.037 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 8 . 1163 . 1 1 8 HIS NE2 N 5.762 -5.694 2.031 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1164 . 1 1 8 HIS O O 2.187 -6.487 0.019 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 8 . 1165 . 1 1 9 LEU C C -1.269 -6.619 0.734 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 8 . 1166 . 1 1 9 LEU CA C -0.092 -6.090 1.546 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 8 . 1167 . 1 1 9 LEU CB C -0.588 -5.531 2.879 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 8 . 1168 . 1 1 9 LEU CD1 C -0.198 -3.988 4.817 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 8 . 1169 . 1 1 9 LEU CD2 C 1.369 -5.893 4.404 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 8 . 1170 . 1 1 9 LEU CG C 0.465 -4.853 3.758 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 8 . 1171 . 1 1 9 LEU H H 0.301 -4.120 0.830 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 8 . 1172 . 1 1 9 LEU HA H 0.534 -6.850 1.720 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 8 . 1173 . 1 1 9 LEU HB2 H -1.301 -4.858 2.683 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1174 . 1 1 9 LEU HB3 H -0.980 -6.288 3.402 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1175 . 1 1 9 LEU HD11 H -0.783 -4.557 5.394 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 8 . 1176 . 1 1 9 LEU HD12 H 0.505 -3.554 5.380 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 8 . 1177 . 1 1 9 LEU HD13 H -0.752 -3.283 4.374 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 8 . 1178 . 1 1 9 LEU HD21 H 0.812 -6.506 4.965 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 8 . 1179 . 1 1 9 LEU HD22 H 1.824 -6.420 3.686 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 8 . 1180 . 1 1 9 LEU HD23 H 2.057 -5.448 4.978 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 8 . 1181 . 1 1 9 LEU HG H 1.050 -4.280 3.184 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 8 . 1182 . 1 1 9 LEU N N 0.632 -5.063 0.805 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 8 . 1183 . 1 1 9 LEU O O -1.348 -7.812 0.441 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 8 . 1184 . 1 1 10 MET C C -3.469 -5.243 -1.666 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 8 . 1185 . 1 1 10 MET CA C -3.354 -6.101 -0.410 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 8 . 1186 . 1 1 10 MET CB C -4.622 -5.963 0.434 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 8 . 1187 . 1 1 10 MET CE C -7.430 -4.300 -0.077 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 8 . 1188 . 1 1 10 MET CG C -4.865 -4.551 0.941 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 8 . 1189 . 1 1 10 MET H H -2.062 -4.768 0.640 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 8 . 1190 . 1 1 10 MET HA H -3.237 -7.051 -0.699 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 8 . 1191 . 1 1 10 MET HB2 H -5.405 -6.237 -0.124 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 8 . 1192 . 1 1 10 MET HB3 H -4.545 -6.573 1.223 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 8 . 1193 . 1 1 10 MET HE1 H -7.074 -3.564 -0.653 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 8 . 1194 . 1 1 10 MET HE2 H -7.281 -5.179 -0.530 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 8 . 1195 . 1 1 10 MET HE3 H -8.409 -4.163 0.072 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 8 . 1196 . 1 1 10 MET HG2 H -4.246 -4.381 1.708 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 8 . 1197 . 1 1 10 MET HG3 H -4.661 -3.911 0.200 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 8 . 1198 . 1 1 10 MET N N -2.182 -5.724 0.371 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 8 . 1199 . 1 1 10 MET O O -4.350 -5.458 -2.499 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 8 . 1200 . 1 1 10 MET SD S -6.563 -4.292 1.489 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 9 . 1201 . 1 1 1 GLY C C -1.791 9.218 -2.833 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 9 . 1202 . 1 1 1 GLY CA C -2.927 9.463 -3.805 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 9 . 1203 . 1 1 1 GLY H1 H -1.791 9.999 -5.385 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 9 . 1204 . 1 1 1 GLY H2 H -3.340 10.507 -5.482 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 9 . 1205 . 1 1 1 GLY H3 H -2.296 11.259 -4.477 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 9 . 1206 . 1 1 1 GLY HA2 H -3.701 9.849 -3.303 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 9 . 1207 . 1 1 1 GLY HA3 H -3.196 8.590 -4.211 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 9 . 1208 . 1 1 1 GLY N N -2.560 10.378 -4.870 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 9 . 1209 . 1 1 1 GLY O O -0.679 8.884 -3.239 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 9 . 1210 . 1 1 2 ASN C C -1.229 7.820 0.153 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 9 . 1211 . 1 1 2 ASN CA C -1.061 9.184 -0.511 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 9 . 1212 . 1 1 2 ASN CB C -1.150 10.291 0.542 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 9 . 1213 . 1 1 2 ASN CG C -2.571 10.531 1.009 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 9 . 1214 . 1 1 2 ASN H H -2.994 9.658 -1.276 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 9 . 1215 . 1 1 2 ASN HA H -0.173 9.174 -0.971 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 9 . 1216 . 1 1 2 ASN HB2 H -0.592 10.030 1.330 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1217 . 1 1 2 ASN HB3 H -0.794 11.138 0.148 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1218 . 1 1 2 ASN HD21 H -2.325 9.241 2.547 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 9 . 1219 . 1 1 2 ASN HD22 H -3.887 9.980 2.443 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 9 . 1220 . 1 1 2 ASN N N -2.070 9.386 -1.544 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 9 . 1221 . 1 1 2 ASN ND2 N -2.960 9.862 2.089 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 9 . 1222 . 1 1 2 ASN O O -1.814 7.710 1.230 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 9 . 1223 . 1 1 2 ASN OD1 O -3.312 11.308 0.407 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 9 . 1224 . 1 1 3 HIS C C -0.009 4.452 -0.837 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 9 . 1225 . 1 1 3 HIS CA C -0.801 5.427 0.030 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 9 . 1226 . 1 1 3 HIS CB C -2.260 4.984 0.111 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 9 . 1227 . 1 1 3 HIS CD2 C -1.717 3.062 1.770 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1228 . 1 1 3 HIS CE1 C -3.677 2.939 2.738 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1229 . 1 1 3 HIS CG C -2.537 3.993 1.207 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 9 . 1230 . 1 1 3 HIS H H -0.244 6.938 -1.370 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 9 . 1231 . 1 1 3 HIS HA H -0.401 5.423 0.946 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 9 . 1232 . 1 1 3 HIS HB2 H -2.828 5.792 0.269 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1233 . 1 1 3 HIS HB3 H -2.512 4.565 -0.761 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1234 . 1 1 3 HIS HD2 H -0.762 2.888 1.530 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1235 . 1 1 3 HIS HE1 H -4.421 2.652 3.342 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1236 . 1 1 3 HIS HE2 H -2.153 1.661 3.338 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1237 . 1 1 3 HIS N N -0.709 6.784 -0.498 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 9 . 1238 . 1 1 3 HIS ND1 N -3.770 3.901 1.831 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 9 . 1239 . 1 1 3 HIS NE2 N -2.454 2.402 2.738 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1240 . 1 1 3 HIS O O -0.426 4.113 -1.944 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 9 . 1241 . 1 1 4 TRP C C 1.953 1.693 -0.409 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 9 . 1242 . 1 1 4 TRP CA C 1.983 3.074 -1.055 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 9 . 1243 . 1 1 4 TRP CB C 3.421 3.595 -1.108 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 9 . 1244 . 1 1 4 TRP CD1 C 4.637 3.291 -3.343 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 9 . 1245 . 1 1 4 TRP CD2 C 4.891 1.581 -1.918 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1246 . 1 1 4 TRP CE2 C 5.603 1.291 -3.098 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1247 . 1 1 4 TRP CE3 C 4.904 0.650 -0.876 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 9 . 1248 . 1 1 4 TRP CG C 4.280 2.865 -2.095 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 9 . 1249 . 1 1 4 TRP CH2 C 6.315 -0.785 -2.226 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 9 . 1250 . 1 1 4 TRP CZ2 C 6.319 0.109 -3.262 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 9 . 1251 . 1 1 4 TRP CZ3 C 5.616 -0.524 -1.041 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 9 . 1252 . 1 1 4 TRP H H 1.418 4.321 0.581 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 9 . 1253 . 1 1 4 TRP HA H 1.603 2.981 -1.975 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 9 . 1254 . 1 1 4 TRP HB2 H 3.401 4.562 -1.362 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1255 . 1 1 4 TRP HB3 H 3.830 3.497 -0.201 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1256 . 1 1 4 TRP HD1 H 4.361 4.160 -3.754 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 9 . 1257 . 1 1 4 TRP HE1 H 5.823 2.422 -4.869 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1258 . 1 1 4 TRP HE3 H 4.408 0.828 -0.026 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 9 . 1259 . 1 1 4 TRP HH2 H 6.821 -1.643 -2.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 9 . 1260 . 1 1 4 TRP HZ2 H 6.818 -0.077 -4.109 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 9 . 1261 . 1 1 4 TRP HZ3 H 5.631 -1.197 -0.301 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 9 . 1262 . 1 1 4 TRP N N 1.134 4.008 -0.325 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 9 . 1263 . 1 1 4 TRP NE1 N 5.432 2.349 -3.952 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1264 . 1 1 4 TRP O O 1.952 0.674 -1.099 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 9 . 1265 . 1 1 5 ALA C C 0.744 -0.471 1.193 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 9 . 1266 . 1 1 5 ALA CA C 1.898 0.411 1.659 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 9 . 1267 . 1 1 5 ALA CB C 1.789 0.680 3.152 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 9 . 1268 . 1 1 5 ALA H H 1.935 2.529 1.425 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 9 . 1269 . 1 1 5 ALA HA H 2.755 -0.076 1.490 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 9 . 1270 . 1 1 5 ALA HB1 H 0.949 1.191 3.336 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 9 . 1271 . 1 1 5 ALA HB2 H 1.768 -0.186 3.651 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1272 . 1 1 5 ALA HB3 H 2.578 1.217 3.450 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1273 . 1 1 5 ALA N N 1.930 1.666 0.920 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 9 . 1274 . 1 1 5 ALA O O 0.815 -1.697 1.272 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 9 . 1275 . 1 1 6 VAL C C -1.120 -1.515 -0.905 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 9 . 1276 . 1 1 6 VAL CA C -1.491 -0.565 0.228 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 9 . 1277 . 1 1 6 VAL CB C -2.587 0.398 -0.259 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 9 . 1278 . 1 1 6 VAL CG1 C -2.071 1.265 -1.398 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 9 . 1279 . 1 1 6 VAL CG2 C -3.825 -0.378 -0.688 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 9 . 1280 . 1 1 6 VAL H H -0.318 1.162 0.671 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 9 . 1281 . 1 1 6 VAL HA H -1.838 -1.117 0.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 9 . 1282 . 1 1 6 VAL HB H -2.818 1.005 0.502 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 9 . 1283 . 1 1 6 VAL HG11 H -1.792 0.687 -2.165 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 9 . 1284 . 1 1 6 VAL HG12 H -2.804 1.878 -1.692 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 9 . 1285 . 1 1 6 VAL HG13 H -1.289 1.805 -1.086 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 9 . 1286 . 1 1 6 VAL HG21 H -4.178 -0.903 0.086 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 9 . 1287 . 1 1 6 VAL HG22 H -4.523 0.267 -1.000 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 9 . 1288 . 1 1 6 VAL HG23 H -3.590 -1.002 -1.434 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 9 . 1289 . 1 1 6 VAL N N -0.320 0.163 0.708 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 9 . 1290 . 1 1 6 VAL O O -1.750 -2.554 -1.088 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 9 . 1291 . 1 1 7 GLY C C 1.050 -3.238 -2.309 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 9 . 1292 . 1 1 7 GLY CA C 0.344 -1.979 -2.773 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 9 . 1293 . 1 1 7 GLY H H 0.386 -0.292 -1.473 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 9 . 1294 . 1 1 7 GLY HA2 H -0.456 -2.240 -3.313 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 9 . 1295 . 1 1 7 GLY HA3 H 0.973 -1.450 -3.343 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 9 . 1296 . 1 1 7 GLY N N -0.092 -1.149 -1.666 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 9 . 1297 . 1 1 7 GLY O O 1.138 -4.217 -3.051 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 9 . 1298 . 1 1 8 HIS C C 1.276 -5.364 0.073 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 9 . 1299 . 1 1 8 HIS CA C 2.260 -4.362 -0.520 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 9 . 1300 . 1 1 8 HIS CB C 3.250 -3.906 0.552 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 9 . 1301 . 1 1 8 HIS CD2 C 3.787 -5.527 2.509 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1302 . 1 1 8 HIS CE1 C 5.329 -6.711 1.503 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1303 . 1 1 8 HIS CG C 3.949 -5.044 1.245 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 9 . 1304 . 1 1 8 HIS H H 1.454 -2.386 -0.528 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 9 . 1305 . 1 1 8 HIS HA H 2.755 -4.815 -1.261 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 9 . 1306 . 1 1 8 HIS HB2 H 3.942 -3.327 0.121 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1307 . 1 1 8 HIS HB3 H 2.753 -3.376 1.239 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1308 . 1 1 8 HIS HD2 H 3.151 -5.184 3.200 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1309 . 1 1 8 HIS HE1 H 6.033 -7.400 1.327 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1310 . 1 1 8 HIS HE2 H 4.807 -7.158 3.464 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1311 . 1 1 8 HIS N N 1.557 -3.213 -1.081 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 9 . 1312 . 1 1 8 HIS ND1 N 4.926 -5.805 0.626 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 9 . 1313 . 1 1 8 HIS NE2 N 4.669 -6.583 2.657 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1314 . 1 1 8 HIS O O 1.551 -6.564 0.126 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 9 . 1315 . 1 1 9 LEU C C -1.879 -6.206 0.050 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 9 . 1316 . 1 1 9 LEU CA C -0.897 -5.718 1.112 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 9 . 1317 . 1 1 9 LEU CB C -1.648 -4.960 2.208 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 9 . 1318 . 1 1 9 LEU CD1 C -1.678 -3.235 4.026 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 9 . 1319 . 1 1 9 LEU CD2 C 0.165 -4.923 3.938 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 9 . 1320 . 1 1 9 LEU CG C -0.795 -4.076 3.117 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 9 . 1321 . 1 1 9 LEU H H -0.036 -3.882 0.449 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 9 . 1322 . 1 1 9 LEU HA H -0.448 -6.517 1.513 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 9 . 1323 . 1 1 9 LEU HB2 H -2.329 -4.376 1.766 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1324 . 1 1 9 LEU HB3 H -2.111 -5.633 2.784 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1325 . 1 1 9 LEU HD11 H -2.270 -2.652 3.470 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 9 . 1326 . 1 1 9 LEU HD12 H -2.241 -3.836 4.594 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 9 . 1327 . 1 1 9 LEU HD13 H -1.103 -2.664 4.612 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 9 . 1328 . 1 1 9 LEU HD21 H 0.760 -5.434 3.318 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 9 . 1329 . 1 1 9 LEU HD22 H 0.722 -4.343 4.532 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 9 . 1330 . 1 1 9 LEU HD23 H -0.362 -5.563 4.497 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 9 . 1331 . 1 1 9 LEU HG H -0.233 -3.471 2.552 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 9 . 1332 . 1 1 9 LEU N N 0.129 -4.866 0.520 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 9 . 1333 . 1 1 9 LEU O O -2.202 -7.391 -0.014 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 9 . 1334 . 1 1 10 MET C C -2.572 -5.772 -3.180 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 9 . 1335 . 1 1 10 MET CA C -3.291 -5.618 -1.844 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 9 . 1336 . 1 1 10 MET CB C -4.373 -4.543 -1.954 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 9 . 1337 . 1 1 10 MET CE C -6.764 -2.702 0.928 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 9 . 1338 . 1 1 10 MET CG C -4.949 -4.121 -0.612 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 9 . 1339 . 1 1 10 MET H H -2.050 -4.334 -0.677 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 9 . 1340 . 1 1 10 MET HA H -3.706 -6.499 -1.617 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 9 . 1341 . 1 1 10 MET HB2 H -3.976 -3.738 -2.394 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 9 . 1342 . 1 1 10 MET HB3 H -5.117 -4.899 -2.519 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 9 . 1343 . 1 1 10 MET HE1 H -6.879 -3.536 1.468 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 9 . 1344 . 1 1 10 MET HE2 H -5.984 -2.183 1.278 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 9 . 1345 . 1 1 10 MET HE3 H -7.592 -2.145 0.994 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 9 . 1346 . 1 1 10 MET HG2 H -5.151 -4.945 -0.083 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 9 . 1347 . 1 1 10 MET HG3 H -4.261 -3.577 -0.131 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 9 . 1348 . 1 1 10 MET N N -2.349 -5.282 -0.782 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 9 . 1349 . 1 1 10 MET O O -2.234 -4.783 -3.832 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 9 . 1350 . 1 1 10 MET SD S -6.457 -3.146 -0.779 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 10 . 1351 . 1 1 1 GLY C C 1.339 9.485 -1.537 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 10 . 1352 . 1 1 1 GLY CA C 2.360 9.354 -2.650 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 10 . 1353 . 1 1 1 GLY H1 H 3.342 11.080 -2.290 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 10 . 1354 . 1 1 1 GLY H2 H 3.561 10.498 -3.800 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 10 . 1355 . 1 1 1 GLY H3 H 2.151 11.217 -3.399 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 10 . 1356 . 1 1 1 GLY HA2 H 1.923 8.918 -3.437 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 10 . 1357 . 1 1 1 GLY HA3 H 3.114 8.782 -2.328 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 10 . 1358 . 1 1 1 GLY N N 2.895 10.637 -3.067 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 10 . 1359 . 1 1 1 GLY O O 1.642 10.015 -0.468 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 10 . 1360 . 1 1 2 ASN C C -0.999 7.790 0.030 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 10 . 1361 . 1 1 2 ASN CA C -0.943 9.070 -0.798 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 10 . 1362 . 1 1 2 ASN CB C -2.289 9.306 -1.486 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 10 . 1363 . 1 1 2 ASN CG C -2.414 10.710 -2.045 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 10 . 1364 . 1 1 2 ASN H H -0.056 8.581 -2.675 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 10 . 1365 . 1 1 2 ASN HA H -0.709 9.811 -0.169 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 10 . 1366 . 1 1 2 ASN HB2 H -2.385 8.651 -2.236 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1367 . 1 1 2 ASN HB3 H -3.020 9.159 -0.820 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1368 . 1 1 2 ASN HD21 H -4.327 10.361 -2.598 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 10 . 1369 . 1 1 2 ASN HD22 H -3.726 11.943 -2.965 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 10 . 1370 . 1 1 2 ASN N N 0.127 9.002 -1.787 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 10 . 1371 . 1 1 2 ASN ND2 N -3.585 11.031 -2.580 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 10 . 1372 . 1 1 2 ASN O O -1.351 7.816 1.211 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 10 . 1373 . 1 1 2 ASN OD1 O -1.467 11.496 -1.996 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 10 . 1374 . 1 1 3 HIS C C 0.031 4.315 -0.763 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 10 . 1375 . 1 1 3 HIS CA C -0.661 5.380 0.083 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 10 . 1376 . 1 1 3 HIS CB C -2.094 4.950 0.388 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 10 . 1377 . 1 1 3 HIS CD2 C -1.407 3.137 2.117 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1378 . 1 1 3 HIS CE1 C -3.109 3.357 3.475 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1379 . 1 1 3 HIS CG C -2.228 4.109 1.629 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 10 . 1380 . 1 1 3 HIS H H -0.376 6.713 -1.556 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 10 . 1381 . 1 1 3 HIS HA H -0.152 5.475 0.938 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 10 . 1382 . 1 1 3 HIS HB2 H -2.653 5.771 0.504 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1383 . 1 1 3 HIS HB3 H -2.437 4.420 -0.388 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1384 . 1 1 3 HIS HD2 H -0.552 2.820 1.707 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1385 . 1 1 3 HIS HE1 H -3.728 3.225 4.249 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1386 . 1 1 3 HIS HE2 H -1.635 1.958 3.895 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1387 . 1 1 3 HIS N N -0.651 6.670 -0.596 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 10 . 1388 . 1 1 3 HIS ND1 N -3.298 4.234 2.500 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 10 . 1389 . 1 1 3 HIS NE2 N -1.980 2.672 3.286 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1390 . 1 1 3 HIS O O -0.534 3.819 -1.738 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 10 . 1391 . 1 1 4 TRP C C 1.963 1.616 -0.400 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 10 . 1392 . 1 1 4 TRP CA C 2.024 2.965 -1.109 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 10 . 1393 . 1 1 4 TRP CB C 3.480 3.412 -1.255 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 10 . 1394 . 1 1 4 TRP CD1 C 4.651 2.507 -3.347 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 10 . 1395 . 1 1 4 TRP CD2 C 4.953 1.261 -1.510 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1396 . 1 1 4 TRP CE2 C 5.643 0.658 -2.581 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1397 . 1 1 4 TRP CE3 C 5.000 0.654 -0.253 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 10 . 1398 . 1 1 4 TRP CG C 4.326 2.442 -2.021 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 10 . 1399 . 1 1 4 TRP CH2 C 6.397 -1.092 -1.187 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 10 . 1400 . 1 1 4 TRP CZ2 C 6.369 -0.520 -2.429 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 10 . 1401 . 1 1 4 TRP CZ3 C 5.720 -0.515 -0.104 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 10 . 1402 . 1 1 4 TRP H H 1.661 4.410 0.417 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 10 . 1403 . 1 1 4 TRP HA H 1.595 2.850 -2.005 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 10 . 1404 . 1 1 4 TRP HB2 H 3.498 4.291 -1.732 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1405 . 1 1 4 TRP HB3 H 3.873 3.521 -0.342 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1406 . 1 1 4 TRP HD1 H 4.356 3.226 -3.976 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 10 . 1407 . 1 1 4 TRP HE1 H 5.815 1.254 -4.599 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1408 . 1 1 4 TRP HE3 H 4.521 1.058 0.526 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 10 . 1409 . 1 1 4 TRP HH2 H 6.910 -1.939 -1.046 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 10 . 1410 . 1 1 4 TRP HZ2 H 6.851 -0.930 -3.203 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 10 . 1411 . 1 1 4 TRP HZ3 H 5.759 -0.957 0.792 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 10 . 1412 . 1 1 4 TRP N N 1.256 3.970 -0.384 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 10 . 1413 . 1 1 4 TRP NE1 N 5.443 1.437 -3.689 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1414 . 1 1 4 TRP O O 2.013 0.566 -1.040 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 10 . 1415 . 1 1 5 ALA C C 0.616 -0.443 1.277 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 10 . 1416 . 1 1 5 ALA CA C 1.784 0.433 1.718 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 10 . 1417 . 1 1 5 ALA CB C 1.662 0.773 3.197 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 10 . 1418 . 1 1 5 ALA H H 1.822 2.539 1.386 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 10 . 1419 . 1 1 5 ALA HA H 2.631 -0.081 1.583 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 10 . 1420 . 1 1 5 ALA HB1 H 0.832 1.311 3.346 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 10 . 1421 . 1 1 5 ALA HB2 H 1.614 -0.069 3.734 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1422 . 1 1 5 ALA HB3 H 2.460 1.305 3.481 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1423 . 1 1 5 ALA N N 1.855 1.653 0.924 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 10 . 1424 . 1 1 5 ALA O O 0.640 -1.661 1.454 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 10 . 1425 . 1 1 6 VAL C C -1.225 -1.496 -0.893 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 10 . 1426 . 1 1 6 VAL CA C -1.582 -0.538 0.236 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 10 . 1427 . 1 1 6 VAL CB C -2.677 0.429 -0.249 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 10 . 1428 . 1 1 6 VAL CG1 C -2.165 1.281 -1.401 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 10 . 1429 . 1 1 6 VAL CG2 C -3.924 -0.341 -0.660 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 10 . 1430 . 1 1 6 VAL H H -0.365 1.178 0.591 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 10 . 1431 . 1 1 6 VAL HA H -1.928 -1.083 1.000 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 10 . 1432 . 1 1 6 VAL HB H -2.896 1.045 0.508 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 10 . 1433 . 1 1 6 VAL HG11 H -1.898 0.694 -2.165 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 10 . 1434 . 1 1 6 VAL HG12 H -2.897 1.897 -1.693 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 10 . 1435 . 1 1 6 VAL HG13 H -1.376 1.818 -1.102 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 10 . 1436 . 1 1 6 VAL HG21 H -4.274 -0.857 0.122 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 10 . 1437 . 1 1 6 VAL HG22 H -4.620 0.306 -0.971 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 10 . 1438 . 1 1 6 VAL HG23 H -3.700 -0.972 -1.403 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 10 . 1439 . 1 1 6 VAL N N -0.405 0.185 0.704 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 10 . 1440 . 1 1 6 VAL O O -1.870 -2.528 -1.074 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 10 . 1441 . 1 1 7 GLY C C 1.039 -3.185 -2.300 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 10 . 1442 . 1 1 7 GLY CA C 0.232 -1.987 -2.759 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 10 . 1443 . 1 1 7 GLY H H 0.296 -0.296 -1.465 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 10 . 1444 . 1 1 7 GLY HA2 H -0.579 -2.314 -3.244 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 10 . 1445 . 1 1 7 GLY HA3 H 0.794 -1.440 -3.380 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 10 . 1446 . 1 1 7 GLY N N -0.193 -1.147 -1.655 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 10 . 1447 . 1 1 7 GLY O O 1.156 -4.178 -3.020 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 10 . 1448 . 1 1 8 HIS C C 1.508 -5.295 -0.009 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 10 . 1449 . 1 1 8 HIS CA C 2.400 -4.179 -0.543 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 10 . 1450 . 1 1 8 HIS CB C 3.303 -3.655 0.576 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 10 . 1451 . 1 1 8 HIS CD2 C 3.811 -5.314 2.508 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1452 . 1 1 8 HIS CE1 C 5.599 -6.237 1.649 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1453 . 1 1 8 HIS CG C 4.055 -4.738 1.297 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 10 . 1454 . 1 1 8 HIS H H 1.467 -2.261 -0.559 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 10 . 1455 . 1 1 8 HIS HA H 2.962 -4.557 -1.279 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 10 . 1456 . 1 1 8 HIS HB2 H 3.967 -3.022 0.178 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1457 . 1 1 8 HIS HB3 H 2.736 -3.169 1.241 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1458 . 1 1 8 HIS HD2 H 3.060 -5.094 3.130 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1459 . 1 1 8 HIS HE1 H 6.401 -6.823 1.530 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1460 . 1 1 8 HIS HE2 H 4.916 -6.863 3.505 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1461 . 1 1 8 HIS N N 1.599 -3.094 -1.097 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 10 . 1462 . 1 1 8 HIS ND1 N 5.189 -5.334 0.769 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 10 . 1463 . 1 1 8 HIS NE2 N 4.799 -6.261 2.715 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1464 . 1 1 8 HIS O O 1.849 -6.475 -0.101 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 10 . 1465 . 1 1 9 LEU C C -1.642 -6.254 0.072 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 10 . 1466 . 1 1 9 LEU CA C -0.578 -5.884 1.101 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 10 . 1467 . 1 1 9 LEU CB C -1.242 -5.322 2.359 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 10 . 1468 . 1 1 9 LEU CD1 C -1.058 -4.046 4.509 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 10 . 1469 . 1 1 9 LEU CD2 C 0.429 -6.014 4.095 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 10 . 1470 . 1 1 9 LEU CG C -0.295 -4.838 3.458 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 10 . 1471 . 1 1 9 LEU H H 0.143 -3.941 0.596 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 10 . 1472 . 1 1 9 LEU HA H -0.071 -6.713 1.338 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 10 . 1473 . 1 1 9 LEU HB2 H -1.812 -4.548 2.085 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1474 . 1 1 9 LEU HB3 H -1.819 -6.040 2.748 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1475 . 1 1 9 LEU HD11 H -1.490 -3.252 4.081 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 10 . 1476 . 1 1 9 LEU HD12 H -1.761 -4.627 4.920 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 10 . 1477 . 1 1 9 LEU HD13 H -0.424 -3.738 5.218 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 10 . 1478 . 1 1 9 LEU HD21 H 0.954 -6.493 3.391 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 10 . 1479 . 1 1 9 LEU HD22 H 1.048 -5.695 4.813 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 10 . 1480 . 1 1 9 LEU HD23 H -0.246 -6.637 4.489 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 10 . 1481 . 1 1 9 LEU HG H 0.407 -4.254 3.051 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 10 . 1482 . 1 1 9 LEU N N 0.364 -4.915 0.551 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 10 . 1483 . 1 1 9 LEU O O -1.796 -7.422 -0.283 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 10 . 1484 . 1 1 10 MET C C -2.919 -5.130 -2.797 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 10 . 1485 . 1 1 10 MET CA C -3.418 -5.469 -1.396 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 10 . 1486 . 1 1 10 MET CB C -4.650 -4.627 -1.062 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 10 . 1487 . 1 1 10 MET CE C -7.741 -5.921 -0.944 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 10 . 1488 . 1 1 10 MET CG C -5.366 -5.071 0.204 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 10 . 1489 . 1 1 10 MET H H -2.196 -4.322 -0.075 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 10 . 1490 . 1 1 10 MET HA H -3.654 -6.441 -1.382 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 10 . 1491 . 1 1 10 MET HB2 H -4.362 -3.677 -0.945 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 10 . 1492 . 1 1 10 MET HB3 H -5.292 -4.689 -1.826 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 10 . 1493 . 1 1 10 MET HE1 H -8.199 -5.228 -0.387 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 10 . 1494 . 1 1 10 MET HE2 H -7.419 -5.505 -1.795 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 10 . 1495 . 1 1 10 MET HE3 H -8.384 -6.657 -1.155 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 10 . 1496 . 1 1 10 MET HG2 H -4.680 -5.239 0.912 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 10 . 1497 . 1 1 10 MET HG3 H -5.973 -4.333 0.498 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 10 . 1498 . 1 1 10 MET N N -2.370 -5.250 -0.404 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 10 . 1499 . 1 1 10 MET O O -3.621 -5.346 -3.786 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 10 . 1500 . 1 1 10 MET SD S -6.338 -6.570 -0.039 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 11 . 1501 . 1 1 1 GLY C C -1.112 9.457 -3.000 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 11 . 1502 . 1 1 1 GLY CA C -1.902 9.323 -4.286 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 11 . 1503 . 1 1 1 GLY H1 H -0.496 10.080 -5.521 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 11 . 1504 . 1 1 1 GLY H2 H -2.008 10.124 -6.136 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 11 . 1505 . 1 1 1 GLY H3 H -1.565 11.189 -4.979 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 11 . 1506 . 1 1 1 GLY HA2 H -2.867 9.499 -4.090 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 11 . 1507 . 1 1 1 GLY HA3 H -1.797 8.390 -4.631 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 11 . 1508 . 1 1 1 GLY N N -1.458 10.251 -5.310 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 11 . 1509 . 1 1 1 GLY O O 0.018 9.943 -3.006 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 11 . 1510 . 1 1 2 ASN C C -1.142 7.765 0.140 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 11 . 1511 . 1 1 2 ASN CA C -1.052 9.101 -0.592 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 11 . 1512 . 1 1 2 ASN CB C -1.685 10.205 0.256 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 11 . 1513 . 1 1 2 ASN CG C -1.228 11.589 -0.162 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 11 . 1514 . 1 1 2 ASN H H -2.628 8.638 -1.955 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 11 . 1515 . 1 1 2 ASN HA H -0.082 9.271 -0.766 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 11 . 1516 . 1 1 2 ASN HB2 H -2.679 10.152 0.161 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1517 . 1 1 2 ASN HB3 H -1.434 10.059 1.213 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1518 . 1 1 2 ASN HD21 H -3.080 12.339 0.155 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 11 . 1519 . 1 1 2 ASN HD22 H -1.903 13.482 -0.399 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 11 . 1520 . 1 1 2 ASN N N -1.708 9.025 -1.894 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 11 . 1521 . 1 1 2 ASN ND2 N -2.146 12.549 -0.133 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 11 . 1522 . 1 1 2 ASN O O -1.610 7.700 1.278 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 11 . 1523 . 1 1 2 ASN OD1 O -0.065 11.793 -0.508 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 11 . 1524 . 1 1 3 HIS C C 0.048 4.375 -0.797 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 11 . 1525 . 1 1 3 HIS CA C -0.719 5.370 0.070 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 11 . 1526 . 1 1 3 HIS CB C -2.161 4.898 0.252 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 11 . 1527 . 1 1 3 HIS CD2 C -1.431 3.060 1.934 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1528 . 1 1 3 HIS CE1 C -3.374 2.745 2.894 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1529 . 1 1 3 HIS CG C -2.341 3.894 1.358 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 11 . 1530 . 1 1 3 HIS H H -0.323 6.821 -1.441 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 11 . 1531 . 1 1 3 HIS HA H -0.268 5.415 0.962 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 11 . 1532 . 1 1 3 HIS HB2 H -2.731 5.694 0.456 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1533 . 1 1 3 HIS HB3 H -2.467 4.480 -0.603 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1534 . 1 1 3 HIS HD2 H -0.462 2.984 1.700 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1535 . 1 1 3 HIS HE1 H -4.087 2.389 3.498 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1536 . 1 1 3 HIS HE2 H -1.730 1.637 3.515 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1537 . 1 1 3 HIS N N -0.691 6.703 -0.519 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 11 . 1538 . 1 1 3 HIS ND1 N -3.561 3.681 1.977 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 11 . 1539 . 1 1 3 HIS NE2 N -2.102 2.337 2.906 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1540 . 1 1 3 HIS O O -0.423 3.976 -1.863 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 11 . 1541 . 1 1 4 TRP C C 2.021 1.657 -0.420 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 11 . 1542 . 1 1 4 TRP CA C 2.061 3.036 -1.071 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 11 . 1543 . 1 1 4 TRP CB C 3.503 3.540 -1.138 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 11 . 1544 . 1 1 4 TRP CD1 C 4.709 3.080 -3.352 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 11 . 1545 . 1 1 4 TRP CD2 C 4.990 1.487 -1.803 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1546 . 1 1 4 TRP CE2 C 5.698 1.116 -2.963 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1547 . 1 1 4 TRP CE3 C 5.022 0.637 -0.695 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 11 . 1548 . 1 1 4 TRP CG C 4.366 2.746 -2.074 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 11 . 1549 . 1 1 4 TRP CH2 C 6.440 -0.880 -1.942 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 11 . 1550 . 1 1 4 TRP CZ2 C 6.427 -0.068 -3.043 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 11 . 1551 . 1 1 4 TRP CZ3 C 5.746 -0.537 -0.776 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 11 . 1552 . 1 1 4 TRP H H 1.556 4.343 0.538 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 11 . 1553 . 1 1 4 TRP HA H 1.671 2.945 -1.987 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 11 . 1554 . 1 1 4 TRP HB2 H 3.495 4.491 -1.447 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1555 . 1 1 4 TRP HB3 H 3.902 3.490 -0.222 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1556 . 1 1 4 TRP HD1 H 4.420 3.912 -3.825 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 11 . 1557 . 1 1 4 TRP HE1 H 5.895 2.112 -4.816 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1558 . 1 1 4 TRP HE3 H 4.530 0.873 0.143 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 11 . 1559 . 1 1 4 TRP HH2 H 6.955 -1.737 -1.968 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 11 . 1560 . 1 1 4 TRP HZ2 H 6.922 -0.312 -3.877 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 11 . 1561 . 1 1 4 TRP HZ3 H 5.774 -1.151 0.012 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 11 . 1562 . 1 1 4 TRP N N 1.229 3.982 -0.335 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 11 . 1563 . 1 1 4 TRP NE1 N 5.510 2.104 -3.893 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1564 . 1 1 4 TRP O O 2.109 0.637 -1.104 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 11 . 1565 . 1 1 5 ALA C C 0.644 -0.468 1.199 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 11 . 1566 . 1 1 5 ALA CA C 1.832 0.380 1.642 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 11 . 1567 . 1 1 5 ALA CB C 1.760 0.652 3.137 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 11 . 1568 . 1 1 5 ALA H H 1.820 2.498 1.400 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 11 . 1569 . 1 1 5 ALA HA H 2.671 -0.132 1.457 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 11 . 1570 . 1 1 5 ALA HB1 H 2.570 1.166 3.419 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 11 . 1571 . 1 1 5 ALA HB2 H 0.939 1.187 3.337 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1572 . 1 1 5 ALA HB3 H 1.723 -0.213 3.637 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1573 . 1 1 5 ALA N N 1.886 1.634 0.901 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 11 . 1574 . 1 1 5 ALA O O 0.662 -1.693 1.324 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 11 . 1575 . 1 1 6 VAL C C -1.255 -1.475 -0.906 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 11 . 1576 . 1 1 6 VAL CA C -1.585 -0.503 0.219 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 11 . 1577 . 1 1 6 VAL CB C -2.654 0.491 -0.269 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 11 . 1578 . 1 1 6 VAL CG1 C -2.162 1.244 -1.496 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 11 . 1579 . 1 1 6 VAL CG2 C -3.958 -0.236 -0.568 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 11 . 1580 . 1 1 6 VAL H H -0.343 1.187 0.609 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 11 . 1581 . 1 1 6 VAL HA H -1.944 -1.035 0.986 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 11 . 1582 . 1 1 6 VAL HB H -2.800 1.161 0.458 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 11 . 1583 . 1 1 6 VAL HG11 H -1.332 1.755 -1.271 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 11 . 1584 . 1 1 6 VAL HG12 H -1.967 0.599 -2.235 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 11 . 1585 . 1 1 6 VAL HG13 H -2.876 1.880 -1.788 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 11 . 1586 . 1 1 6 VAL HG21 H -4.291 -0.685 0.261 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 11 . 1587 . 1 1 6 VAL HG22 H -4.637 0.428 -0.883 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 11 . 1588 . 1 1 6 VAL HG23 H -3.806 -0.921 -1.281 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 11 . 1589 . 1 1 6 VAL N N -0.388 0.191 0.682 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 11 . 1590 . 1 1 6 VAL O O -1.925 -2.493 -1.077 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 11 . 1591 . 1 1 7 GLY C C 1.244 -3.017 -2.371 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 11 . 1592 . 1 1 7 GLY CA C 0.183 -2.011 -2.774 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 11 . 1593 . 1 1 7 GLY H H 0.294 -0.316 -1.489 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 11 . 1594 . 1 1 7 GLY HA2 H -0.620 -2.507 -3.104 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 11 . 1595 . 1 1 7 GLY HA3 H 0.546 -1.439 -3.509 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 11 . 1596 . 1 1 7 GLY N N -0.217 -1.156 -1.673 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 11 . 1597 . 1 1 7 GLY O O 1.967 -3.541 -3.218 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 11 . 1598 . 1 1 8 HIS C C 1.636 -5.356 0.218 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 11 . 1599 . 1 1 8 HIS CA C 2.320 -4.234 -0.558 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 11 . 1600 . 1 1 8 HIS CB C 3.330 -3.519 0.342 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 11 . 1601 . 1 1 8 HIS CD2 C 4.491 -4.698 2.344 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1602 . 1 1 8 HIS CE1 C 5.878 -5.942 1.197 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1603 . 1 1 8 HIS CG C 4.295 -4.453 1.017 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 11 . 1604 . 1 1 8 HIS H H 0.722 -2.827 -0.434 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 11 . 1605 . 1 1 8 HIS HA H 2.796 -4.642 -1.337 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 11 . 1606 . 1 1 8 HIS HB2 H 3.853 -2.874 -0.216 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1607 . 1 1 8 HIS HB3 H 2.829 -3.019 1.048 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1608 . 1 1 8 HIS HD2 H 4.000 -4.274 3.105 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1609 . 1 1 8 HIS HE1 H 6.594 -6.601 0.969 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1610 . 1 1 8 HIS HE2 H 5.880 -6.041 3.273 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1611 . 1 1 8 HIS N N 1.339 -3.286 -1.073 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 11 . 1612 . 1 1 8 HIS ND1 N 5.180 -5.248 0.309 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 11 . 1613 . 1 1 8 HIS NE2 N 5.495 -5.642 2.441 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1614 . 1 1 8 HIS O O 2.053 -6.513 0.154 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 11 . 1615 . 1 1 9 LEU C C -1.288 -6.599 0.923 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 11 . 1616 . 1 1 9 LEU CA C -0.157 -5.983 1.741 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 11 . 1617 . 1 1 9 LEU CB C -0.721 -5.326 3.001 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 11 . 1618 . 1 1 9 LEU CD1 C -0.561 -3.593 4.805 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 11 . 1619 . 1 1 9 LEU CD2 C 1.428 -5.005 4.250 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 11 . 1620 . 1 1 9 LEU CG C 0.190 -4.315 3.697 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 11 . 1621 . 1 1 9 LEU H H 0.295 -4.049 0.962 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 11 . 1622 . 1 1 9 LEU HA H 0.472 -6.714 2.005 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 11 . 1623 . 1 1 9 LEU HB2 H -1.565 -4.853 2.748 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1624 . 1 1 9 LEU HB3 H -0.930 -6.051 3.657 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1625 . 1 1 9 LEU HD11 H -1.345 -3.109 4.416 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 11 . 1626 . 1 1 9 LEU HD12 H -0.881 -4.258 5.480 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 11 . 1627 . 1 1 9 LEU HD13 H 0.050 -2.937 5.248 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 11 . 1628 . 1 1 9 LEU HD21 H 1.924 -5.436 3.496 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 11 . 1629 . 1 1 9 LEU HD22 H 2.023 -4.342 4.705 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 11 . 1630 . 1 1 9 LEU HD23 H 1.145 -5.704 4.906 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 11 . 1631 . 1 1 9 LEU HG H 0.510 -3.646 3.026 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 11 . 1632 . 1 1 9 LEU N N 0.585 -5.006 0.951 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 11 . 1633 . 1 1 9 LEU O O -1.563 -7.793 1.027 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 11 . 1634 . 1 1 10 MET C C -2.513 -6.860 -2.019 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 11 . 1635 . 1 1 10 MET CA C -3.038 -6.237 -0.729 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 11 . 1636 . 1 1 10 MET CB C -3.982 -5.079 -1.056 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 11 . 1637 . 1 1 10 MET CE C -5.785 -4.996 2.607 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 11 . 1638 . 1 1 10 MET CG C -4.590 -4.424 0.174 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 11 . 1639 . 1 1 10 MET H H -1.668 -4.811 0.071 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 11 . 1640 . 1 1 10 MET HA H -3.529 -6.947 -0.224 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 11 . 1641 . 1 1 10 MET HB2 H -3.469 -4.385 -1.562 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 11 . 1642 . 1 1 10 MET HB3 H -4.725 -5.427 -1.628 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 11 . 1643 . 1 1 10 MET HE1 H -4.884 -5.295 2.921 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 11 . 1644 . 1 1 10 MET HE2 H -5.873 -4.009 2.738 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 11 . 1645 . 1 1 10 MET HE3 H -6.494 -5.466 3.132 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 11 . 1646 . 1 1 10 MET HG2 H -3.875 -4.331 0.866 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 11 . 1647 . 1 1 10 MET HG3 H -4.923 -3.517 -0.085 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 11 . 1648 . 1 1 10 MET N N -1.939 -5.773 0.109 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 11 . 1649 . 1 1 10 MET O O -3.287 -7.338 -2.849 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 11 . 1650 . 1 1 10 MET SD S -5.956 -5.376 0.866 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 12 . 1651 . 1 1 1 GLY C C -1.733 9.702 -1.225 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 12 . 1652 . 1 1 1 GLY CA C -2.902 10.558 -1.668 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 12 . 1653 . 1 1 1 GLY H1 H -3.463 9.419 -3.237 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 12 . 1654 . 1 1 1 GLY H2 H -3.999 10.960 -3.314 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 12 . 1655 . 1 1 1 GLY H3 H -2.432 10.623 -3.630 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 12 . 1656 . 1 1 1 GLY HA2 H -2.673 11.519 -1.514 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 12 . 1657 . 1 1 1 GLY HA3 H -3.703 10.315 -1.121 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 12 . 1658 . 1 1 1 GLY N N -3.224 10.376 -3.071 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 12 . 1659 . 1 1 1 GLY O O -1.039 9.112 -2.052 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 12 . 1660 . 1 1 2 ASN C C -0.815 7.376 0.761 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 12 . 1661 . 1 1 2 ASN CA C -0.418 8.844 0.636 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 12 . 1662 . 1 1 2 ASN CB C -0.006 9.391 2.004 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 12 . 1663 . 1 1 2 ASN CG C 0.214 10.892 1.984 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 12 . 1664 . 1 1 2 ASN H H -2.114 10.135 0.706 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 12 . 1665 . 1 1 2 ASN HA H 0.331 8.886 -0.025 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 12 . 1666 . 1 1 2 ASN HB2 H -0.727 9.180 2.664 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1667 . 1 1 2 ASN HB3 H 0.844 8.945 2.285 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1668 . 1 1 2 ASN HD21 H -0.118 11.005 3.976 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 12 . 1669 . 1 1 2 ASN HD22 H 0.235 12.511 3.197 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 12 . 1670 . 1 1 2 ASN N N -1.513 9.633 0.084 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 12 . 1671 . 1 1 2 ASN ND2 N 0.101 11.521 3.148 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 12 . 1672 . 1 1 2 ASN O O -1.217 6.920 1.832 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 12 . 1673 . 1 1 2 ASN OD1 O 0.482 11.477 0.935 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 12 . 1674 . 1 1 3 HIS C C 0.038 4.408 -1.057 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 12 . 1675 . 1 1 3 HIS CA C -1.043 5.224 -0.353 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 12 . 1676 . 1 1 3 HIS CB C -2.390 5.009 -1.045 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 12 . 1677 . 1 1 3 HIS CD2 C -3.877 4.053 0.856 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1678 . 1 1 3 HIS CE1 C -5.407 5.621 0.858 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1679 . 1 1 3 HIS CG C -3.558 4.972 -0.098 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 12 . 1680 . 1 1 3 HIS H H -0.365 7.070 -1.180 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 12 . 1681 . 1 1 3 HIS HA H -1.101 4.910 0.595 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 12 . 1682 . 1 1 3 HIS HB2 H -2.536 5.755 -1.694 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1683 . 1 1 3 HIS HB3 H -2.358 4.140 -1.538 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1684 . 1 1 3 HIS HD2 H -3.361 3.227 1.083 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1685 . 1 1 3 HIS HE1 H -6.222 6.151 1.092 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1686 . 1 1 3 HIS HE2 H -5.558 4.035 2.192 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1687 . 1 1 3 HIS N N -0.698 6.641 -0.340 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 12 . 1688 . 1 1 3 HIS ND1 N -4.535 5.954 -0.082 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 12 . 1689 . 1 1 3 HIS NE2 N -5.051 4.479 1.453 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1690 . 1 1 3 HIS O O -0.030 4.181 -2.265 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 12 . 1691 . 1 1 4 TRP C C 2.083 1.750 -0.324 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 12 . 1692 . 1 1 4 TRP CA C 2.129 3.183 -0.844 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 12 . 1693 . 1 1 4 TRP CB C 3.473 3.822 -0.492 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 12 . 1694 . 1 1 4 TRP CD1 C 5.228 3.955 -2.354 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 12 . 1695 . 1 1 4 TRP CD2 C 5.264 2.041 -1.190 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1696 . 1 1 4 TRP CE2 C 6.269 1.987 -2.175 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1697 . 1 1 4 TRP CE3 C 5.097 0.948 -0.336 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 12 . 1698 . 1 1 4 TRP CG C 4.610 3.309 -1.322 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 12 . 1699 . 1 1 4 TRP CH2 C 6.917 -0.175 -1.477 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 12 . 1700 . 1 1 4 TRP CZ2 C 7.102 0.881 -2.327 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 12 . 1701 . 1 1 4 TRP CZ3 C 5.925 -0.148 -0.489 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 12 . 1702 . 1 1 4 TRP H H 1.031 4.190 0.683 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 12 . 1703 . 1 1 4 TRP HA H 2.001 3.145 -1.835 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 12 . 1704 . 1 1 4 TRP HB2 H 3.403 4.810 -0.630 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1705 . 1 1 4 TRP HB3 H 3.674 3.633 0.469 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1706 . 1 1 4 TRP HD1 H 4.989 4.868 -2.685 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 12 . 1707 . 1 1 4 TRP HE1 H 6.827 3.411 -3.634 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1708 . 1 1 4 TRP HE3 H 4.392 0.957 0.373 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 12 . 1709 . 1 1 4 TRP HH2 H 7.500 -0.983 -1.561 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 12 . 1710 . 1 1 4 TRP HZ2 H 7.809 0.864 -3.034 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 12 . 1711 . 1 1 4 TRP HZ3 H 5.813 -0.935 0.117 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 12 . 1712 . 1 1 4 TRP N N 1.033 3.972 -0.293 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 12 . 1713 . 1 1 4 TRP NE1 N 6.227 3.166 -2.872 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1714 . 1 1 4 TRP O O 2.084 0.797 -1.103 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 12 . 1715 . 1 1 5 ALA C C 0.767 -0.494 1.153 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 12 . 1716 . 1 1 5 ALA CA C 1.990 0.288 1.619 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 12 . 1717 . 1 1 5 ALA CB C 1.989 0.420 3.135 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 12 . 1718 . 1 1 5 ALA H H 2.042 2.419 1.576 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 12 . 1719 . 1 1 5 ALA HA H 2.809 -0.219 1.350 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 12 . 1720 . 1 1 5 ALA HB1 H 1.190 0.949 3.420 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 12 . 1721 . 1 1 5 ALA HB2 H 1.955 -0.487 3.554 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1722 . 1 1 5 ALA HB3 H 2.822 0.890 3.427 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1723 . 1 1 5 ALA N N 2.040 1.605 0.996 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 12 . 1724 . 1 1 5 ALA O O 0.762 -1.725 1.168 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 12 . 1725 . 1 1 6 VAL C C -1.222 -1.351 -0.887 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 12 . 1726 . 1 1 6 VAL CA C -1.500 -0.397 0.269 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 12 . 1727 . 1 1 6 VAL CB C -2.527 0.656 -0.181 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 12 . 1728 . 1 1 6 VAL CG1 C -1.961 1.508 -1.308 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 12 . 1729 . 1 1 6 VAL CG2 C -3.824 -0.015 -0.612 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 12 . 1730 . 1 1 6 VAL H H -0.204 1.228 0.755 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 12 . 1731 . 1 1 6 VAL HA H -1.876 -0.935 1.023 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 12 . 1732 . 1 1 6 VAL HB H -2.702 1.261 0.596 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 12 . 1733 . 1 1 6 VAL HG11 H -1.137 1.981 -0.995 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 12 . 1734 . 1 1 6 VAL HG12 H -1.736 0.929 -2.092 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 12 . 1735 . 1 1 6 VAL HG13 H -2.650 2.181 -1.578 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 12 . 1736 . 1 1 6 VAL HG21 H -4.207 -0.531 0.154 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 12 . 1737 . 1 1 6 VAL HG22 H -4.475 0.687 -0.900 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 12 . 1738 . 1 1 6 VAL HG23 H -3.644 -0.636 -1.375 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 12 . 1739 . 1 1 6 VAL N N -0.269 0.230 0.741 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 12 . 1740 . 1 1 6 VAL O O -1.974 -2.298 -1.118 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 12 . 1741 . 1 1 7 GLY C C 1.221 -3.014 -2.359 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 12 . 1742 . 1 1 7 GLY CA C 0.221 -1.941 -2.735 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 12 . 1743 . 1 1 7 GLY H H 0.438 -0.312 -1.379 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 12 . 1744 . 1 1 7 GLY HA2 H -0.607 -2.382 -3.082 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 12 . 1745 . 1 1 7 GLY HA3 H 0.619 -1.369 -3.452 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 12 . 1746 . 1 1 7 GLY N N -0.138 -1.096 -1.611 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 12 . 1747 . 1 1 7 GLY O O 1.931 -3.542 -3.216 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 12 . 1748 . 1 1 8 HIS C C 1.449 -5.489 0.110 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 12 . 1749 . 1 1 8 HIS CA C 2.204 -4.357 -0.581 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 12 . 1750 . 1 1 8 HIS CB C 3.214 -3.738 0.387 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 12 . 1751 . 1 1 8 HIS CD2 C 4.219 -5.064 2.380 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1752 . 1 1 8 HIS CE1 C 5.591 -6.331 1.237 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1753 . 1 1 8 HIS CG C 4.098 -4.752 1.060 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 12 . 1754 . 1 1 8 HIS H H 0.678 -2.876 -0.421 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 12 . 1755 . 1 1 8 HIS HA H 2.687 -4.742 -1.367 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 12 . 1756 . 1 1 8 HIS HB2 H 3.794 -3.102 -0.122 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1757 . 1 1 8 HIS HB3 H 2.713 -3.239 1.093 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1758 . 1 1 8 HIS HD2 H 3.717 -4.648 3.138 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1759 . 1 1 8 HIS HE1 H 6.282 -7.017 1.009 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1760 . 1 1 8 HIS HE2 H 5.496 -6.525 3.303 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1761 . 1 1 8 HIS N N 1.281 -3.340 -1.070 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 12 . 1762 . 1 1 8 HIS ND1 N 4.971 -5.562 0.353 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 12 . 1763 . 1 1 8 HIS NE2 N 5.169 -6.067 2.476 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1764 . 1 1 8 HIS O O 1.846 -6.652 0.035 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 12 . 1765 . 1 1 9 LEU C C -1.723 -6.446 0.708 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 12 . 1766 . 1 1 9 LEU CA C -0.453 -6.125 1.490 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 12 . 1767 . 1 1 9 LEU CB C -0.814 -5.613 2.885 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 12 . 1768 . 1 1 9 LEU CD1 C -0.259 -4.168 4.857 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 12 . 1769 . 1 1 9 LEU CD2 C 1.372 -5.898 4.079 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 12 . 1770 . 1 1 9 LEU CG C 0.303 -4.902 3.650 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 12 . 1771 . 1 1 9 LEU H H 0.089 -4.178 0.810 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 12 . 1772 . 1 1 9 LEU HA H 0.081 -6.966 1.577 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 12 . 1773 . 1 1 9 LEU HB2 H -1.574 -4.971 2.788 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1774 . 1 1 9 LEU HB3 H -1.108 -6.397 3.432 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1775 . 1 1 9 LEU HD11 H -0.927 -3.488 4.553 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 12 . 1776 . 1 1 9 LEU HD12 H -0.704 -4.822 5.468 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 12 . 1777 . 1 1 9 LEU HD13 H 0.485 -3.710 5.344 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 12 . 1778 . 1 1 9 LEU HD21 H 1.753 -6.337 3.266 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 12 . 1779 . 1 1 9 LEU HD22 H 2.102 -5.432 4.579 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 12 . 1780 . 1 1 9 LEU HD23 H 0.955 -6.591 4.667 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 12 . 1781 . 1 1 9 LEU HG H 0.748 -4.244 3.043 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 12 . 1782 . 1 1 9 LEU N N 0.359 -5.140 0.785 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 12 . 1783 . 1 1 9 LEU O O -2.064 -7.611 0.509 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 12 . 1784 . 1 1 10 MET C C -3.346 -5.805 -1.974 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 12 . 1785 . 1 1 10 MET CA C -3.649 -5.573 -0.497 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 12 . 1786 . 1 1 10 MET CB C -4.548 -4.347 -0.336 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 12 . 1787 . 1 1 10 MET CE C -6.968 -3.323 2.901 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 12 . 1788 . 1 1 10 MET CG C -5.033 -4.132 1.089 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 12 . 1789 . 1 1 10 MET H H -2.089 -4.479 0.461 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 12 . 1790 . 1 1 10 MET HA H -4.115 -6.387 -0.149 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 12 . 1791 . 1 1 10 MET HB2 H -4.034 -3.537 -0.620 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 12 . 1792 . 1 1 10 MET HB3 H -5.346 -4.459 -0.928 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 12 . 1793 . 1 1 10 MET HE1 H -7.098 -4.291 3.117 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 12 . 1794 . 1 1 10 MET HE2 H -6.222 -2.955 3.456 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 12 . 1795 . 1 1 10 MET HE3 H -7.810 -2.821 3.100 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 12 . 1796 . 1 1 10 MET HG2 H -5.199 -5.027 1.503 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 12 . 1797 . 1 1 10 MET HG3 H -4.314 -3.658 1.598 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 12 . 1798 . 1 1 10 MET N N -2.418 -5.403 0.266 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 12 . 1799 . 1 1 10 MET O O -4.113 -6.459 -2.681 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 12 . 1800 . 1 1 10 MET SD S -6.549 -3.158 1.168 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 13 . 1801 . 1 1 1 GLY C C -1.578 8.289 -3.083 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 13 . 1802 . 1 1 1 GLY CA C -2.621 8.157 -4.175 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 13 . 1803 . 1 1 1 GLY H1 H -2.820 6.151 -4.086 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 13 . 1804 . 1 1 1 GLY H2 H -3.326 6.803 -5.495 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 13 . 1805 . 1 1 1 GLY H3 H -1.728 6.659 -5.190 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 13 . 1806 . 1 1 1 GLY HA2 H -2.432 8.837 -4.883 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 13 . 1807 . 1 1 1 GLY HA3 H -3.523 8.330 -3.780 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 13 . 1808 . 1 1 1 GLY N N -2.624 6.840 -4.784 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 13 . 1809 . 1 1 1 GLY O O -0.431 7.876 -3.257 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 13 . 1810 . 1 1 2 ASN C C -1.029 7.809 0.053 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 13 . 1811 . 1 1 2 ASN CA C -1.066 9.053 -0.830 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 13 . 1812 . 1 1 2 ASN CB C -1.488 10.267 -0.001 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 13 . 1813 . 1 1 2 ASN CG C -1.659 11.515 -0.848 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 13 . 1814 . 1 1 2 ASN H H -2.921 9.180 -1.873 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 13 . 1815 . 1 1 2 ASN HA H -0.149 9.162 -1.214 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 13 . 1816 . 1 1 2 ASN HB2 H -2.357 10.062 0.449 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1817 . 1 1 2 ASN HB3 H -0.788 10.442 0.691 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1818 . 1 1 2 ASN HD21 H -3.673 11.363 -0.733 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 13 . 1819 . 1 1 2 ASN HD22 H -3.081 12.708 -1.651 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 13 . 1820 . 1 1 2 ASN N N -1.975 8.866 -1.954 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 13 . 1821 . 1 1 2 ASN ND2 N -2.907 11.893 -1.098 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 13 . 1822 . 1 1 2 ASN O O -1.326 7.872 1.246 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 13 . 1823 . 1 1 2 ASN OD1 O -0.680 12.129 -1.271 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 13 . 1824 . 1 1 3 HIS C C 0.022 4.322 -0.681 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 13 . 1825 . 1 1 3 HIS CA C -0.583 5.420 0.189 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 13 . 1826 . 1 1 3 HIS CB C -1.970 4.997 0.669 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 13 . 1827 . 1 1 3 HIS CD2 C -1.158 3.162 2.318 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1828 . 1 1 3 HIS CE1 C -2.558 3.581 3.946 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1829 . 1 1 3 HIS CG C -1.958 4.201 1.946 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 13 . 1830 . 1 1 3 HIS H H -0.430 6.693 -1.516 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 13 . 1831 . 1 1 3 HIS HA H 0.016 5.556 0.978 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 13 . 1832 . 1 1 3 HIS HB2 H -2.518 5.820 0.818 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1833 . 1 1 3 HIS HB3 H -2.395 4.439 -0.044 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1834 . 1 1 3 HIS HD2 H -0.425 2.752 1.776 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1835 . 1 1 3 HIS HE1 H -3.037 3.529 4.822 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1836 . 1 1 3 HIS HE2 H -1.172 2.050 4.154 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1837 . 1 1 3 HIS N N -0.660 6.679 -0.543 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 13 . 1838 . 1 1 3 HIS ND1 N -2.836 4.451 2.986 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 13 . 1839 . 1 1 3 HIS NE2 N -1.552 2.782 3.588 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1840 . 1 1 3 HIS O O -0.641 3.782 -1.566 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 13 . 1841 . 1 1 4 TRP C C 1.920 1.624 -0.458 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 13 . 1842 . 1 1 4 TRP CA C 1.978 2.965 -1.182 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 13 . 1843 . 1 1 4 TRP CB C 3.435 3.369 -1.418 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 13 . 1844 . 1 1 4 TRP CD1 C 4.472 2.385 -3.545 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 13 . 1845 . 1 1 4 TRP CD2 C 4.827 1.167 -1.700 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1846 . 1 1 4 TRP CE2 C 5.444 0.522 -2.790 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1847 . 1 1 4 TRP CE3 C 4.918 0.584 -0.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 13 . 1848 . 1 1 4 TRP CG C 4.211 2.357 -2.205 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 13 . 1849 . 1 1 4 TRP CH2 C 6.213 -1.223 -1.397 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 13 . 1850 . 1 1 4 TRP CZ2 C 6.140 -0.675 -2.649 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 13 . 1851 . 1 1 4 TRP CZ3 C 5.610 -0.604 -0.295 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 13 . 1852 . 1 1 4 TRP H H 1.768 4.474 0.312 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 13 . 1853 . 1 1 4 TRP HA H 1.494 2.856 -2.050 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 13 . 1854 . 1 1 4 TRP HB2 H 3.449 4.235 -1.917 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1855 . 1 1 4 TRP HB3 H 3.881 3.488 -0.531 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1856 . 1 1 4 TRP HD1 H 4.169 3.101 -4.174 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 13 . 1857 . 1 1 4 TRP HE1 H 5.531 1.071 -4.828 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1858 . 1 1 4 TRP HE3 H 4.490 1.018 0.360 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 13 . 1859 . 1 1 4 TRP HH2 H 6.706 -2.083 -1.264 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 13 . 1860 . 1 1 4 TRP HZ2 H 6.570 -1.116 -3.437 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 13 . 1861 . 1 1 4 TRP HZ3 H 5.681 -1.028 0.608 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 13 . 1862 . 1 1 4 TRP N N 1.283 3.998 -0.422 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 13 . 1863 . 1 1 4 TRP NE1 N 5.212 1.284 -3.904 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1864 . 1 1 4 TRP O O 1.952 0.567 -1.088 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 13 . 1865 . 1 1 5 ALA C C 0.603 -0.418 1.250 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 13 . 1866 . 1 1 5 ALA CA C 1.771 0.464 1.676 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 13 . 1867 . 1 1 5 ALA CB C 1.657 0.820 3.151 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 13 . 1868 . 1 1 5 ALA H H 1.814 2.567 1.320 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 13 . 1869 . 1 1 5 ALA HA H 2.619 -0.050 1.542 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 13 . 1870 . 1 1 5 ALA HB1 H 0.827 1.358 3.298 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 13 . 1871 . 1 1 5 ALA HB2 H 1.614 -0.016 3.698 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1872 . 1 1 5 ALA HB3 H 2.455 1.356 3.425 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1873 . 1 1 5 ALA N N 1.835 1.676 0.867 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 13 . 1874 . 1 1 5 ALA O O 0.625 -1.633 1.446 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 13 . 1875 . 1 1 6 VAL C C -1.250 -1.483 -0.920 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 13 . 1876 . 1 1 6 VAL CA C -1.599 -0.528 0.215 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 13 . 1877 . 1 1 6 VAL CB C -2.704 0.432 -0.256 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 13 . 1878 . 1 1 6 VAL CG1 C -2.262 1.188 -1.501 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 13 . 1879 . 1 1 6 VAL CG2 C -3.996 -0.329 -0.519 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 13 . 1880 . 1 1 6 VAL H H -0.380 1.193 0.540 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 13 . 1881 . 1 1 6 VAL HA H -1.932 -1.076 0.982 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 13 . 1882 . 1 1 6 VAL HB H -2.851 1.105 0.469 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 13 . 1883 . 1 1 6 VAL HG11 H -2.067 0.542 -2.239 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 13 . 1884 . 1 1 6 VAL HG12 H -3.000 1.802 -1.782 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 13 . 1885 . 1 1 6 VAL HG13 H -1.441 1.723 -1.300 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 13 . 1886 . 1 1 6 VAL HG21 H -4.298 -0.779 0.321 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 13 . 1887 . 1 1 6 VAL HG22 H -4.699 0.314 -0.823 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 13 . 1888 . 1 1 6 VAL HG23 H -3.843 -1.016 -1.229 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 13 . 1889 . 1 1 6 VAL N N -0.420 0.202 0.669 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 13 . 1890 . 1 1 6 VAL O O -1.924 -2.490 -1.128 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 13 . 1891 . 1 1 7 GLY C C 1.288 -3.004 -2.357 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 13 . 1892 . 1 1 7 GLY CA C 0.230 -1.998 -2.763 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 13 . 1893 . 1 1 7 GLY H H 0.323 -0.327 -1.444 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 13 . 1894 . 1 1 7 GLY HA2 H -0.566 -2.492 -3.111 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 13 . 1895 . 1 1 7 GLY HA3 H 0.602 -1.414 -3.485 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 13 . 1896 . 1 1 7 GLY N N -0.190 -1.159 -1.656 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 13 . 1897 . 1 1 7 GLY O O 2.026 -3.514 -3.202 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 13 . 1898 . 1 1 8 HIS C C 1.650 -5.405 0.157 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 13 . 1899 . 1 1 8 HIS CA C 2.344 -4.241 -0.545 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 13 . 1900 . 1 1 8 HIS CB C 3.303 -3.547 0.422 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 13 . 1901 . 1 1 8 HIS CD2 C 4.328 -5.230 2.113 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1902 . 1 1 8 HIS CE1 C 6.264 -5.504 1.127 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1903 . 1 1 8 HIS CG C 4.355 -4.462 0.988 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 13 . 1904 . 1 1 8 HIS H H 0.738 -2.842 -0.425 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 13 . 1905 . 1 1 8 HIS HA H 2.859 -4.609 -1.319 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 13 . 1906 . 1 1 8 HIS HB2 H 3.762 -2.803 -0.064 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1907 . 1 1 8 HIS HB3 H 2.772 -3.171 1.181 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1908 . 1 1 8 HIS HD2 H 3.572 -5.307 2.763 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1909 . 1 1 8 HIS HE1 H 7.190 -5.824 0.927 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1910 . 1 1 8 HIS HE2 H 5.856 -6.525 2.888 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1911 . 1 1 8 HIS N N 1.366 -3.290 -1.062 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 13 . 1912 . 1 1 8 HIS ND1 N 5.584 -4.647 0.379 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 13 . 1913 . 1 1 8 HIS NE2 N 5.546 -5.884 2.186 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1914 . 1 1 8 HIS O O 2.092 -6.552 0.064 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 13 . 1915 . 1 1 9 LEU C C -1.384 -6.598 0.759 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 13 . 1916 . 1 1 9 LEU CA C -0.189 -6.124 1.580 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 13 . 1917 . 1 1 9 LEU CB C -0.665 -5.580 2.927 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 13 . 1918 . 1 1 9 LEU CD1 C -0.252 -4.148 4.943 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 13 . 1919 . 1 1 9 LEU CD2 C 1.404 -5.911 4.304 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 13 . 1920 . 1 1 9 LEU CG C 0.397 -4.894 3.787 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 13 . 1921 . 1 1 9 LEU H H 0.257 -4.152 0.897 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 13 . 1922 . 1 1 9 LEU HA H 0.414 -6.907 1.735 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 13 . 1923 . 1 1 9 LEU HB2 H -1.391 -4.915 2.750 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1924 . 1 1 9 LEU HB3 H -1.036 -6.345 3.453 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1925 . 1 1 9 LEU HD11 H -0.876 -3.454 4.584 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 13 . 1926 . 1 1 9 LEU HD12 H -0.762 -4.793 5.512 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 13 . 1927 . 1 1 9 LEU HD13 H 0.457 -3.707 5.493 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 13 . 1928 . 1 1 9 LEU HD21 H 1.845 -6.358 3.525 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 13 . 1929 . 1 1 9 LEU HD22 H 2.098 -5.461 4.866 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 13 . 1930 . 1 1 9 LEU HD23 H 0.923 -6.595 4.852 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 13 . 1931 . 1 1 9 LEU HG H 0.907 -4.246 3.222 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 13 . 1932 . 1 1 9 LEU N N 0.565 -5.103 0.860 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 13 . 1933 . 1 1 9 LEU O O -1.501 -7.782 0.442 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 13 . 1934 . 1 1 10 MET C C -3.436 -5.251 -1.705 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 13 . 1935 . 1 1 10 MET CA C -3.452 -5.989 -0.370 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 13 . 1936 . 1 1 10 MET CB C -4.720 -5.632 0.408 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 13 . 1937 . 1 1 10 MET CE C -7.253 -3.298 0.060 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 13 . 1938 . 1 1 10 MET CG C -4.759 -4.187 0.877 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 13 . 1939 . 1 1 10 MET H H -2.116 -4.722 0.706 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 13 . 1940 . 1 1 10 MET HA H -3.434 -6.970 -0.563 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 13 . 1941 . 1 1 10 MET HB2 H -5.510 -5.793 -0.183 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 13 . 1942 . 1 1 10 MET HB3 H -4.777 -6.226 1.210 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 13 . 1943 . 1 1 10 MET HE1 H -6.778 -2.552 -0.406 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 13 . 1944 . 1 1 10 MET HE2 H -7.285 -4.098 -0.539 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 13 . 1945 . 1 1 10 MET HE3 H -8.184 -3.011 0.284 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 13 . 1946 . 1 1 10 MET HG2 H -4.059 -4.066 1.581 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 13 . 1947 . 1 1 10 MET HG3 H -4.551 -3.597 0.096 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 13 . 1948 . 1 1 10 MET N N -2.267 -5.667 0.417 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 13 . 1949 . 1 1 10 MET O O -3.513 -5.867 -2.768 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 13 . 1950 . 1 1 10 MET SD S -6.362 -3.719 1.556 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 14 . 1951 . 1 1 1 GLY C C 0.637 9.791 -1.468 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 14 . 1952 . 1 1 1 GLY CA C 0.307 10.289 -2.861 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 14 . 1953 . 1 1 1 GLY H1 H 2.037 11.277 -3.187 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 14 . 1954 . 1 1 1 GLY H2 H 0.806 11.767 -4.142 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 14 . 1955 . 1 1 1 GLY H3 H 0.848 12.212 -2.571 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 14 . 1956 . 1 1 1 GLY HA2 H -0.669 10.501 -2.903 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 14 . 1957 . 1 1 1 GLY HA3 H 0.519 9.566 -3.519 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 14 . 1958 . 1 1 1 GLY N N 1.058 11.479 -3.218 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 14 . 1959 . 1 1 1 GLY O O 1.794 9.818 -1.051 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 14 . 1960 . 1 1 2 ASN C C -0.681 7.391 0.726 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 14 . 1961 . 1 1 2 ASN CA C -0.194 8.832 0.608 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 14 . 1962 . 1 1 2 ASN CB C -0.937 9.717 1.612 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 14 . 1963 . 1 1 2 ASN CG C -0.880 11.186 1.241 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 14 . 1964 . 1 1 2 ASN H H -1.300 9.342 -1.142 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 14 . 1965 . 1 1 2 ASN HA H 0.791 8.819 0.778 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 14 . 1966 . 1 1 2 ASN HB2 H -1.895 9.430 1.645 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 1967 . 1 1 2 ASN HB3 H -0.522 9.597 2.514 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 1968 . 1 1 2 ASN HD21 H 0.926 11.378 2.132 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 14 . 1969 . 1 1 2 ASN HD22 H 0.298 12.822 1.410 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 14 . 1970 . 1 1 2 ASN N N -0.382 9.337 -0.746 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 14 . 1971 . 1 1 2 ASN ND2 N 0.204 11.850 1.626 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 14 . 1972 . 1 1 2 ASN O O -1.191 6.980 1.768 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 14 . 1973 . 1 1 2 ASN OD1 O -1.798 11.718 0.616 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 14 . 1974 . 1 1 3 HIS C C 0.096 4.360 -1.071 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 14 . 1975 . 1 1 3 HIS CA C -0.941 5.233 -0.369 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 14 . 1976 . 1 1 3 HIS CB C -2.295 5.094 -1.064 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 14 . 1977 . 1 1 3 HIS CD2 C -3.739 4.123 0.862 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 14 . 1978 . 1 1 3 HIS CE1 C -5.337 5.620 0.824 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 14 . 1979 . 1 1 3 HIS CG C -3.460 5.029 -0.116 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 14 . 1980 . 1 1 3 HIS H H -0.095 7.020 -1.168 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 14 . 1981 . 1 1 3 HIS HA H -1.020 4.920 0.578 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 14 . 1982 . 1 1 3 HIS HB2 H -2.424 5.882 -1.666 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 1983 . 1 1 3 HIS HB3 H -2.287 4.256 -1.609 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 1984 . 1 1 3 HIS HD2 H -3.187 3.327 1.111 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 14 . 1985 . 1 1 3 HIS HE1 H -6.174 6.120 1.045 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 14 . 1986 . 1 1 3 HIS HE2 H -5.420 4.064 2.198 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 14 . 1987 . 1 1 3 HIS N N -0.518 6.628 -0.351 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 14 . 1988 . 1 1 3 HIS ND1 N -4.479 5.967 -0.126 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 14 . 1989 . 1 1 3 HIS NE2 N -4.932 4.511 1.448 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 14 . 1990 . 1 1 3 HIS O O -0.002 4.108 -2.272 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 14 . 1991 . 1 1 4 TRP C C 2.056 1.646 -0.309 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 14 . 1992 . 1 1 4 TRP CA C 2.144 3.062 -0.866 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 14 . 1993 . 1 1 4 TRP CB C 3.516 3.662 -0.556 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 14 . 1994 . 1 1 4 TRP CD1 C 5.236 3.641 -2.456 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 14 . 1995 . 1 1 4 TRP CD2 C 5.242 1.793 -1.191 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 14 . 1996 . 1 1 4 TRP CE2 C 6.224 1.657 -2.191 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 14 . 1997 . 1 1 4 TRP CE3 C 5.063 0.754 -0.275 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 14 . 1998 . 1 1 4 TRP CG C 4.621 3.071 -1.379 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 14 . 1999 . 1 1 4 TRP CH2 C 6.826 -0.482 -1.387 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 14 . 2000 . 1 1 4 TRP CZ2 C 7.023 0.521 -2.298 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 14 . 2001 . 1 1 4 TRP CZ3 C 5.856 -0.373 -0.382 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 14 . 2002 . 1 1 4 TRP H H 1.112 4.146 0.655 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 14 . 2003 . 1 1 4 TRP HA H 1.995 3.004 -1.853 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 14 . 2004 . 1 1 4 TRP HB2 H 3.482 4.646 -0.733 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 2005 . 1 1 4 TRP HB3 H 3.723 3.504 0.410 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 2006 . 1 1 4 TRP HD1 H 5.017 4.542 -2.831 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 14 . 2007 . 1 1 4 TRP HE1 H 6.790 2.980 -3.736 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 14 . 2008 . 1 1 4 TRP HE3 H 4.374 0.823 0.446 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 14 . 2009 . 1 1 4 TRP HH2 H 7.384 -1.310 -1.438 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 14 . 2010 . 1 1 4 TRP HZ2 H 7.715 0.445 -3.016 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 14 . 2011 . 1 1 4 TRP HZ3 H 5.735 -1.122 0.269 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 14 . 2012 . 1 1 4 TRP N N 1.088 3.905 -0.315 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 14 . 2013 . 1 1 4 TRP NE1 N 6.200 2.796 -2.950 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 14 . 2014 . 1 1 4 TRP O O 2.074 0.672 -1.060 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 14 . 2015 . 1 1 5 ALA C C 0.639 -0.527 1.195 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 14 . 2016 . 1 1 5 ALA CA C 1.867 0.242 1.669 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 14 . 2017 . 1 1 5 ALA CB C 1.831 0.416 3.181 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 14 . 2018 . 1 1 5 ALA H H 1.951 2.371 1.569 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 14 . 2019 . 1 1 5 ALA HA H 2.681 -0.289 1.434 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 14 . 2020 . 1 1 5 ALA HB1 H 2.666 0.877 3.481 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 14 . 2021 . 1 1 5 ALA HB2 H 1.036 0.969 3.431 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 2022 . 1 1 5 ALA HB3 H 1.767 -0.479 3.623 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 2023 . 1 1 5 ALA N N 1.960 1.540 1.012 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 14 . 2024 . 1 1 5 ALA O O 0.612 -1.757 1.230 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 14 . 2025 . 1 1 6 VAL C C -1.329 -1.370 -0.879 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 14 . 2026 . 1 1 6 VAL CA C -1.610 -0.408 0.268 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 14 . 2027 . 1 1 6 VAL CB C -2.619 0.656 -0.199 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 14 . 2028 . 1 1 6 VAL CG1 C -2.019 1.512 -1.306 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 14 . 2029 . 1 1 6 VAL CG2 C -3.909 -0.002 -0.664 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 14 . 2030 . 1 1 6 VAL H H -0.295 1.203 0.750 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 14 . 2031 . 1 1 6 VAL HA H -2.002 -0.937 1.020 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 14 . 2032 . 1 1 6 VAL HB H -2.809 1.256 0.578 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 14 . 2033 . 1 1 6 VAL HG11 H -1.779 0.937 -2.088 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 14 . 2034 . 1 1 6 VAL HG12 H -2.696 2.192 -1.588 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 14 . 2035 . 1 1 6 VAL HG13 H -1.200 1.977 -0.970 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 14 . 2036 . 1 1 6 VAL HG21 H -4.314 -0.520 0.090 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 14 . 2037 . 1 1 6 VAL HG22 H -4.548 0.707 -0.962 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 14 . 2038 . 1 1 6 VAL HG23 H -3.716 -0.619 -1.427 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 14 . 2039 . 1 1 6 VAL N N -0.377 0.206 0.752 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 14 . 2040 . 1 1 6 VAL O O -2.090 -2.309 -1.115 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 14 . 2041 . 1 1 7 GLY C C 0.969 -3.169 -2.284 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 14 . 2042 . 1 1 7 GLY CA C 0.125 -1.984 -2.710 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 14 . 2043 . 1 1 7 GLY H H 0.346 -0.351 -1.360 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 14 . 2044 . 1 1 7 GLY HA2 H -0.712 -2.324 -3.138 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 14 . 2045 . 1 1 7 GLY HA3 H 0.642 -1.443 -3.373 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 14 . 2046 . 1 1 7 GLY N N -0.236 -1.130 -1.594 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 14 . 2047 . 1 1 7 GLY O O 1.046 -4.173 -2.994 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 14 . 2048 . 1 1 8 HIS C C 1.602 -5.235 0.012 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 14 . 2049 . 1 1 8 HIS CA C 2.448 -4.125 -0.604 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 14 . 2050 . 1 1 8 HIS CB C 3.424 -3.575 0.440 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 14 . 2051 . 1 1 8 HIS CD2 C 4.193 -5.026 2.451 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 14 . 2052 . 1 1 8 HIS CE1 C 5.647 -6.268 1.385 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 14 . 2053 . 1 1 8 HIS CG C 4.213 -4.644 1.143 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 14 . 2054 . 1 1 8 HIS H H 1.505 -2.212 -0.593 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 14 . 2055 . 1 1 8 HIS HA H 2.960 -4.515 -1.369 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 14 . 2056 . 1 1 8 HIS HB2 H 4.065 -2.959 -0.017 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 2057 . 1 1 8 HIS HB3 H 2.903 -3.065 1.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 2058 . 1 1 8 HIS HD2 H 3.625 -4.636 3.176 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 14 . 2059 . 1 1 8 HIS HE1 H 6.342 -6.960 1.192 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 14 . 2060 . 1 1 8 HIS HE2 H 5.339 -6.561 3.419 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 14 . 2061 . 1 1 8 HIS N N 1.606 -3.054 -1.123 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 14 . 2062 . 1 1 8 HIS ND1 N 5.137 -5.440 0.486 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 14 . 2063 . 1 1 8 HIS NE2 N 5.107 -6.055 2.588 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 14 . 2064 . 1 1 8 HIS O O 1.921 -6.417 -0.118 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 14 . 2065 . 1 1 9 LEU C C -1.368 -6.376 0.309 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 14 . 2066 . 1 1 9 LEU CA C -0.371 -5.808 1.316 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 14 . 2067 . 1 1 9 LEU CB C -1.121 -5.148 2.475 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 14 . 2068 . 1 1 9 LEU CD1 C -1.193 -3.395 4.266 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 14 . 2069 . 1 1 9 LEU CD2 C 0.662 -5.074 4.235 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 14 . 2070 . 1 1 9 LEU CG C -0.289 -4.244 3.385 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 14 . 2071 . 1 1 9 LEU H H 0.316 -3.870 0.746 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 14 . 2072 . 1 1 9 LEU HA H 0.182 -6.563 1.668 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 14 . 2073 . 1 1 9 LEU HB2 H -1.859 -4.595 2.087 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 2074 . 1 1 9 LEU HB3 H -1.511 -5.874 3.041 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 2075 . 1 1 9 LEU HD11 H -1.779 -2.824 3.691 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 14 . 2076 . 1 1 9 LEU HD12 H -1.761 -3.991 4.834 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 14 . 2077 . 1 1 9 LEU HD13 H -0.632 -2.811 4.853 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 14 . 2078 . 1 1 9 LEU HD21 H 1.271 -5.590 3.633 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 14 . 2079 . 1 1 9 LEU HD22 H 1.205 -4.481 4.830 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 14 . 2080 . 1 1 9 LEU HD23 H 0.129 -5.709 4.794 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 14 . 2081 . 1 1 9 LEU HG H 0.278 -3.644 2.821 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 14 . 2082 . 1 1 9 LEU N N 0.522 -4.846 0.679 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 14 . 2083 . 1 1 9 LEU O O -1.454 -7.589 0.125 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 14 . 2084 . 1 1 10 MET C C -2.425 -6.578 -2.522 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 14 . 2085 . 1 1 10 MET CA C -3.100 -5.902 -1.333 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 14 . 2086 . 1 1 10 MET CB C -3.911 -4.695 -1.810 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 14 . 2087 . 1 1 10 MET CE C -6.949 -3.332 0.685 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 14 . 2088 . 1 1 10 MET CG C -4.625 -3.960 -0.688 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 14 . 2089 . 1 1 10 MET H H -1.994 -4.514 -0.148 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 14 . 2090 . 1 1 10 MET HA H -3.704 -6.573 -0.902 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 14 . 2091 . 1 1 10 MET HB2 H -3.290 -4.055 -2.262 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 14 . 2092 . 1 1 10 MET HB3 H -4.596 -5.013 -2.465 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 14 . 2093 . 1 1 10 MET HE1 H -6.382 -3.251 1.505 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 14 . 2094 . 1 1 10 MET HE2 H -6.946 -2.463 0.190 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 14 . 2095 . 1 1 10 MET HE3 H -7.886 -3.562 0.949 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 14 . 2096 . 1 1 10 MET HG2 H -4.076 -4.045 0.143 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 14 . 2097 . 1 1 10 MET HG3 H -4.699 -2.995 -0.941 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 14 . 2098 . 1 1 10 MET N N -2.113 -5.488 -0.342 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 14 . 2099 . 1 1 10 MET O O -1.271 -6.289 -2.841 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 14 . 2100 . 1 1 10 MET SD S -6.276 -4.612 -0.371 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 15 . 2101 . 1 1 1 GLY C C 1.305 9.011 -1.356 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 15 . 2102 . 1 1 1 GLY CA C 2.305 8.971 -2.493 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 15 . 2103 . 1 1 1 GLY H1 H 3.805 9.925 -1.536 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 15 . 2104 . 1 1 1 GLY H2 H 3.935 9.955 -3.164 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 15 . 2105 . 1 1 1 GLY H3 H 2.846 10.914 -2.414 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 15 . 2106 . 1 1 1 GLY HA2 H 1.813 9.075 -3.357 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 15 . 2107 . 1 1 1 GLY HA3 H 2.771 8.086 -2.480 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 15 . 2108 . 1 1 1 GLY N N 3.300 10.023 -2.394 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 15 . 2109 . 1 1 1 GLY O O 1.683 9.002 -0.186 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 15 . 2110 . 1 1 2 ASN C C -1.076 7.809 0.110 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 15 . 2111 . 1 1 2 ASN CA C -1.038 9.101 -0.699 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 15 . 2112 . 1 1 2 ASN CB C -2.393 9.337 -1.369 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 15 . 2113 . 1 1 2 ASN CG C -2.972 8.067 -1.962 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 15 . 2114 . 1 1 2 ASN H H -0.223 9.062 -2.671 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 15 . 2115 . 1 1 2 ASN HA H -0.803 9.835 -0.061 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 15 . 2116 . 1 1 2 ASN HB2 H -3.031 9.693 -0.686 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2117 . 1 1 2 ASN HB3 H -2.277 10.010 -2.100 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2118 . 1 1 2 ASN HD21 H -2.013 8.400 -3.711 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 15 . 2119 . 1 1 2 ASN HD22 H -2.979 6.963 -3.657 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 15 . 2120 . 1 1 2 ASN N N 0.022 9.057 -1.701 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 15 . 2121 . 1 1 2 ASN ND2 N -2.626 7.787 -3.213 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 15 . 2122 . 1 1 2 ASN O O -1.483 7.803 1.272 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 15 . 2123 . 1 1 2 ASN OD1 O -3.723 7.348 -1.303 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 15 . 2124 . 1 1 3 HIS C C 0.033 4.364 -0.733 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 15 . 2125 . 1 1 3 HIS CA C -0.632 5.416 0.150 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 15 . 2126 . 1 1 3 HIS CB C -2.054 4.978 0.497 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 15 . 2127 . 1 1 3 HIS CD2 C -1.292 3.139 2.166 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2128 . 1 1 3 HIS CE1 C -2.964 3.298 3.571 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2129 . 1 1 3 HIS CG C -2.142 4.107 1.721 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 15 . 2130 . 1 1 3 HIS H H -0.329 6.783 -1.457 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 15 . 2131 . 1 1 3 HIS HA H -0.094 5.502 0.989 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 15 . 2132 . 1 1 3 HIS HB2 H -2.608 5.796 0.654 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2133 . 1 1 3 HIS HB3 H -2.426 4.468 -0.278 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2134 . 1 1 3 HIS HD2 H -0.442 2.847 1.728 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2135 . 1 1 3 HIS HE1 H -3.561 3.138 4.357 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2136 . 1 1 3 HIS HE2 H -1.455 1.915 3.921 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2137 . 1 1 3 HIS N N -0.648 6.714 -0.512 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 15 . 2138 . 1 1 3 HIS ND1 N -3.191 4.193 2.621 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 15 . 2139 . 1 1 3 HIS NE2 N -1.828 2.637 3.338 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2140 . 1 1 3 HIS O O -0.550 3.903 -1.713 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 15 . 2141 . 1 1 4 TRP C C 1.954 1.635 -0.451 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 15 . 2142 . 1 1 4 TRP CA C 2.003 2.995 -1.139 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 15 . 2143 . 1 1 4 TRP CB C 3.457 3.439 -1.314 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 15 . 2144 . 1 1 4 TRP CD1 C 4.551 2.572 -3.464 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 15 . 2145 . 1 1 4 TRP CD2 C 4.924 1.296 -1.662 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2146 . 1 1 4 TRP CE2 C 5.574 0.714 -2.767 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2147 . 1 1 4 TRP CE3 C 5.019 0.668 -0.417 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 15 . 2148 . 1 1 4 TRP CG C 4.275 2.484 -2.129 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 15 . 2149 . 1 1 4 TRP CH2 C 6.383 -1.059 -1.433 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 15 . 2150 . 1 1 4 TRP CZ2 C 6.307 -0.465 -2.664 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 15 . 2151 . 1 1 4 TRP CZ3 C 5.746 -0.502 -0.315 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 15 . 2152 . 1 1 4 TRP H H 1.679 4.405 0.430 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 15 . 2153 . 1 1 4 TRP HA H 1.551 2.897 -2.026 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 15 . 2154 . 1 1 4 TRP HB2 H 3.466 4.330 -1.768 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2155 . 1 1 4 TRP HB3 H 3.877 3.522 -0.410 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2156 . 1 1 4 TRP HD1 H 4.232 3.302 -4.069 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 15 . 2157 . 1 1 4 TRP HE1 H 5.668 1.348 -4.781 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2158 . 1 1 4 TRP HE3 H 4.569 1.058 0.386 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 15 . 2159 . 1 1 4 TRP HH2 H 6.902 -1.907 -1.326 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 15 . 2160 . 1 1 4 TRP HZ2 H 6.760 -0.860 -3.463 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 15 . 2161 . 1 1 4 TRP HZ3 H 5.819 -0.959 0.571 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 15 . 2162 . 1 1 4 TRP N N 1.258 3.992 -0.378 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 15 . 2163 . 1 1 4 TRP NE1 N 5.331 1.512 -3.854 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2164 . 1 1 4 TRP O O 2.008 0.596 -1.106 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 15 . 2165 . 1 1 5 ALA C C 0.617 -0.449 1.215 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 15 . 2166 . 1 1 5 ALA CA C 1.793 0.419 1.651 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 15 . 2167 . 1 1 5 ALA CB C 1.697 0.736 3.136 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 15 . 2168 . 1 1 5 ALA H H 1.815 2.531 1.350 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 15 . 2169 . 1 1 5 ALA HA H 2.637 -0.093 1.494 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 15 . 2170 . 1 1 5 ALA HB1 H 0.871 1.273 3.307 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 15 . 2171 . 1 1 5 ALA HB2 H 1.657 -0.114 3.661 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2172 . 1 1 5 ALA HB3 H 2.500 1.262 3.415 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2173 . 1 1 5 ALA N N 1.852 1.652 0.874 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 15 . 2174 . 1 1 5 ALA O O 0.642 -1.669 1.372 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 15 . 2175 . 1 1 6 VAL C C -1.252 -1.498 -0.913 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 15 . 2176 . 1 1 6 VAL CA C -1.598 -0.526 0.207 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 15 . 2177 . 1 1 6 VAL CB C -2.683 0.449 -0.286 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 15 . 2178 . 1 1 6 VAL CG1 C -2.197 1.214 -1.508 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 15 . 2179 . 1 1 6 VAL CG2 C -3.971 -0.300 -0.594 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 15 . 2180 . 1 1 6 VAL H H -0.373 1.183 0.570 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 15 . 2181 . 1 1 6 VAL HA H -1.949 -1.060 0.976 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 15 . 2182 . 1 1 6 VAL HB H -2.847 1.115 0.442 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 15 . 2183 . 1 1 6 VAL HG11 H -1.985 0.575 -2.247 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 15 . 2184 . 1 1 6 VAL HG12 H -2.921 1.837 -1.804 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 15 . 2185 . 1 1 6 VAL HG13 H -1.379 1.740 -1.277 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 15 . 2186 . 1 1 6 VAL HG21 H -4.301 -0.757 0.232 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 15 . 2187 . 1 1 6 VAL HG22 H -4.660 0.352 -0.912 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 15 . 2188 . 1 1 6 VAL HG23 H -3.802 -0.981 -1.307 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 15 . 2189 . 1 1 6 VAL N N -0.412 0.189 0.668 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 15 . 2190 . 1 1 6 VAL O O -1.912 -2.522 -1.086 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 15 . 2191 . 1 1 7 GLY C C 1.263 -3.025 -2.358 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 15 . 2192 . 1 1 7 GLY CA C 0.201 -2.025 -2.772 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 15 . 2193 . 1 1 7 GLY H H 0.287 -0.325 -1.492 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 15 . 2194 . 1 1 7 GLY HA2 H -0.597 -2.525 -3.109 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 15 . 2195 . 1 1 7 GLY HA3 H 0.568 -1.452 -3.504 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 15 . 2196 . 1 1 7 GLY N N -0.214 -1.171 -1.676 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 15 . 2197 . 1 1 7 GLY O O 1.982 -3.563 -3.201 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 15 . 2198 . 1 1 8 HIS C C 1.659 -5.372 0.189 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 15 . 2199 . 1 1 8 HIS CA C 2.346 -4.215 -0.532 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 15 . 2200 . 1 1 8 HIS CB C 3.306 -3.504 0.423 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 15 . 2201 . 1 1 8 HIS CD2 C 4.445 -4.933 2.269 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2202 . 1 1 8 HIS CE1 C 6.147 -5.644 1.092 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2203 . 1 1 8 HIS CG C 4.349 -4.414 1.013 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 15 . 2204 . 1 1 8 HIS H H 0.749 -2.805 -0.421 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 15 . 2205 . 1 1 8 HIS HA H 2.858 -4.591 -1.304 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 15 . 2206 . 1 1 8 HIS HB2 H 3.771 -2.775 -0.078 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2207 . 1 1 8 HIS HB3 H 2.774 -3.107 1.171 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2208 . 1 1 8 HIS HD2 H 3.809 -4.782 3.025 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2209 . 1 1 8 HIS HE1 H 6.991 -6.113 0.831 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2210 . 1 1 8 HIS HE2 H 5.955 -6.231 3.072 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2211 . 1 1 8 HIS N N 1.363 -3.274 -1.056 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 15 . 2212 . 1 1 8 HIS ND1 N 5.432 -4.874 0.283 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 15 . 2213 . 1 1 8 HIS NE2 N 5.590 -5.709 2.301 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2214 . 1 1 8 HIS O O 2.146 -6.503 0.174 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 15 . 2215 . 1 1 9 LEU C C -1.316 -6.701 0.668 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 15 . 2216 . 1 1 9 LEU CA C -0.226 -6.096 1.548 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 15 . 2217 . 1 1 9 LEU CB C -0.849 -5.492 2.807 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 15 . 2218 . 1 1 9 LEU CD1 C -0.666 -3.923 4.754 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 15 . 2219 . 1 1 9 LEU CD2 C 1.030 -5.736 4.449 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 15 . 2220 . 1 1 9 LEU CG C 0.109 -4.752 3.741 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 15 . 2221 . 1 1 9 LEU H H 0.183 -4.141 0.795 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 15 . 2222 . 1 1 9 LEU HA H 0.405 -6.826 1.809 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 15 . 2223 . 1 1 9 LEU HB2 H -1.555 -4.845 2.519 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2224 . 1 1 9 LEU HB3 H -1.270 -6.235 3.328 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2225 . 1 1 9 LEU HD11 H -1.232 -3.253 4.274 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 15 . 2226 . 1 1 9 LEU HD12 H -1.251 -4.524 5.299 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 15 . 2227 . 1 1 9 LEU HD13 H -0.024 -3.447 5.355 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 15 . 2228 . 1 1 9 LEU HD21 H 0.475 -6.376 4.981 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 15 . 2229 . 1 1 9 LEU HD22 H 1.556 -6.240 3.764 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 15 . 2230 . 1 1 9 LEU HD23 H 1.656 -5.251 5.059 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 15 . 2231 . 1 1 9 LEU HG H 0.693 -4.148 3.199 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 15 . 2232 . 1 1 9 LEU N N 0.527 -5.080 0.820 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 15 . 2233 . 1 1 9 LEU O O -1.302 -7.898 0.382 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 15 . 2234 . 1 1 10 MET C C -2.819 -7.045 -1.840 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 15 . 2235 . 1 1 10 MET CA C -3.351 -6.317 -0.610 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 15 . 2236 . 1 1 10 MET CB C -4.214 -5.129 -1.041 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 15 . 2237 . 1 1 10 MET CE C -6.672 -4.463 2.259 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 15 . 2238 . 1 1 10 MET CG C -4.913 -4.435 0.117 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 15 . 2239 . 1 1 10 MET H H -2.210 -4.902 0.507 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 15 . 2240 . 1 1 10 MET HA H -3.899 -6.967 -0.083 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 15 . 2241 . 1 1 10 MET HB2 H -3.628 -4.462 -1.502 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 15 . 2242 . 1 1 10 MET HB3 H -4.910 -5.458 -1.679 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 15 . 2243 . 1 1 10 MET HE1 H -5.868 -4.434 2.853 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 15 . 2244 . 1 1 10 MET HE2 H -6.926 -3.532 1.996 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 15 . 2245 . 1 1 10 MET HE3 H -7.432 -4.891 2.747 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 15 . 2246 . 1 1 10 MET HG2 H -4.241 -4.277 0.841 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 15 . 2247 . 1 1 10 MET HG3 H -5.264 -3.557 -0.209 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 15 . 2248 . 1 1 10 MET N N -2.255 -5.865 0.240 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 15 . 2249 . 1 1 10 MET O O -1.866 -6.594 -2.477 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 15 . 2250 . 1 1 10 MET SD S -6.279 -5.402 0.786 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 16 . 2251 . 1 1 1 GLY C C -0.232 8.757 -3.041 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 16 . 2252 . 1 1 1 GLY CA C -0.623 8.547 -4.491 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 16 . 2253 . 1 1 1 GLY H1 H 0.218 6.725 -4.711 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 16 . 2254 . 1 1 1 GLY H2 H -0.043 7.507 -6.121 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 16 . 2255 . 1 1 1 GLY H3 H 1.191 7.960 -5.153 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 16 . 2256 . 1 1 1 GLY HA2 H -0.584 9.427 -4.965 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 16 . 2257 . 1 1 1 GLY HA3 H -1.557 8.192 -4.523 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 16 . 2258 . 1 1 1 GLY N N 0.254 7.612 -5.172 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 16 . 2259 . 1 1 1 GLY O O 0.951 8.842 -2.717 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 16 . 2260 . 1 1 2 ASN C C -1.098 7.734 0.020 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 16 . 2261 . 1 1 2 ASN CA C -0.985 9.049 -0.745 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 16 . 2262 . 1 1 2 ASN CB C -1.976 10.069 -0.177 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 16 . 2263 . 1 1 2 ASN CG C -3.416 9.621 -0.327 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 16 . 2264 . 1 1 2 ASN H H -2.173 8.770 -2.495 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 16 . 2265 . 1 1 2 ASN HA H -0.037 9.355 -0.656 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 16 . 2266 . 1 1 2 ASN HB2 H -1.779 10.200 0.795 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2267 . 1 1 2 ASN HB3 H -1.857 10.936 -0.661 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2268 . 1 1 2 ASN HD21 H -3.733 9.844 1.659 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 16 . 2269 . 1 1 2 ASN HD22 H -5.100 9.296 0.747 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 16 . 2270 . 1 1 2 ASN N N -1.231 8.845 -2.168 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 16 . 2271 . 1 1 2 ASN ND2 N -4.143 9.584 0.785 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 16 . 2272 . 1 1 2 ASN O O -1.555 7.707 1.164 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 16 . 2273 . 1 1 2 ASN OD1 O -3.871 9.312 -1.428 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 16 . 2274 . 1 1 3 HIS C C 0.049 4.308 -0.821 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 16 . 2275 . 1 1 3 HIS CA C -0.728 5.328 0.004 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 16 . 2276 . 1 1 3 HIS CB C -2.177 4.871 0.165 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 16 . 2277 . 1 1 3 HIS CD2 C -1.532 3.071 1.921 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2278 . 1 1 3 HIS CE1 C -3.471 2.927 2.929 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2279 . 1 1 3 HIS CG C -2.398 3.935 1.321 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 16 . 2280 . 1 1 3 HIS H H -0.316 6.734 -1.546 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 16 . 2281 . 1 1 3 HIS HA H -0.296 5.392 0.904 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 16 . 2282 . 1 1 3 HIS HB2 H -2.750 5.679 0.303 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2283 . 1 1 3 HIS HB3 H -2.456 4.404 -0.674 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2284 . 1 1 3 HIS HD2 H -0.575 2.921 1.674 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2285 . 1 1 3 HIS HE1 H -4.193 2.647 3.562 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2286 . 1 1 3 HIS HE2 H -1.887 1.746 3.573 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2287 . 1 1 3 HIS N N -0.677 6.646 -0.617 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 16 . 2288 . 1 1 3 HIS ND1 N -3.617 3.830 1.971 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 16 . 2289 . 1 1 3 HIS NE2 N -2.227 2.439 2.938 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2290 . 1 1 3 HIS O O -0.416 3.858 -1.869 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 16 . 2291 . 1 1 4 TRP C C 2.010 1.615 -0.364 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 16 . 2292 . 1 1 4 TRP CA C 2.078 2.981 -1.040 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 16 . 2293 . 1 1 4 TRP CB C 3.526 3.472 -1.080 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 16 . 2294 . 1 1 4 TRP CD1 C 4.815 2.890 -3.217 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 16 . 2295 . 1 1 4 TRP CD2 C 5.015 1.375 -1.580 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2296 . 1 1 4 TRP CE2 C 5.765 0.939 -2.689 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2297 . 1 1 4 TRP CE3 C 4.992 0.582 -0.429 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 16 . 2298 . 1 1 4 TRP CG C 4.416 2.625 -1.939 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 16 . 2299 . 1 1 4 TRP CH2 C 6.442 -1.010 -1.539 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 16 . 2300 . 1 1 4 TRP CZ2 C 6.483 -0.254 -2.679 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 16 . 2301 . 1 1 4 TRP CZ3 C 5.704 -0.601 -0.421 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 16 . 2302 . 1 1 4 TRP H H 1.558 4.349 0.513 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 16 . 2303 . 1 1 4 TRP HA H 1.711 2.875 -1.964 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 16 . 2304 . 1 1 4 TRP HB2 H 3.537 4.405 -1.439 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2305 . 1 1 4 TRP HB3 H 3.890 3.469 -0.149 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2306 . 1 1 4 TRP HD1 H 4.555 3.700 -3.743 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 16 . 2307 . 1 1 4 TRP HE1 H 6.050 1.837 -4.580 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2308 . 1 1 4 TRP HE3 H 4.469 0.866 0.375 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 16 . 2309 . 1 1 4 TRP HH2 H 6.948 -1.872 -1.501 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 16 . 2310 . 1 1 4 TRP HZ2 H 7.009 -0.544 -3.479 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 16 . 2311 . 1 1 4 TRP HZ3 H 5.692 -1.175 0.398 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 16 . 2312 . 1 1 4 TRP N N 1.235 3.948 -0.344 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 16 . 2313 . 1 1 4 TRP NE1 N 5.627 1.880 -3.675 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2314 . 1 1 4 TRP O O 2.062 0.581 -1.029 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 16 . 2315 . 1 1 5 ALA C C 0.636 -0.472 1.267 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 16 . 2316 . 1 1 5 ALA CA C 1.816 0.381 1.724 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 16 . 2317 . 1 1 5 ALA CB C 1.706 0.684 3.211 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 16 . 2318 . 1 1 5 ALA H H 1.857 2.495 1.444 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 16 . 2319 . 1 1 5 ALA HA H 2.657 -0.137 1.570 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 16 . 2320 . 1 1 5 ALA HB1 H 0.882 1.225 3.378 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 16 . 2321 . 1 1 5 ALA HB2 H 1.654 -0.171 3.727 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2322 . 1 1 5 ALA HB3 H 2.510 1.202 3.504 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2323 . 1 1 5 ALA N N 1.893 1.620 0.960 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 16 . 2324 . 1 1 5 ALA O O 0.652 -1.695 1.407 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 16 . 2325 . 1 1 6 VAL C C -1.225 -1.485 -0.882 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 16 . 2326 . 1 1 6 VAL CA C -1.573 -0.520 0.244 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 16 . 2327 . 1 1 6 VAL CB C -2.643 0.468 -0.251 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 16 . 2328 . 1 1 6 VAL CG1 C -2.100 1.319 -1.390 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 16 . 2329 . 1 1 6 VAL CG2 C -3.897 -0.278 -0.685 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 16 . 2330 . 1 1 6 VAL H H -0.337 1.175 0.637 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 16 . 2331 . 1 1 6 VAL HA H -1.936 -1.058 1.005 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 16 . 2332 . 1 1 6 VAL HB H -2.863 1.083 0.507 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 16 . 2333 . 1 1 6 VAL HG11 H -1.832 0.732 -2.154 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 16 . 2334 . 1 1 6 VAL HG12 H -2.817 1.949 -1.689 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 16 . 2335 . 1 1 6 VAL HG13 H -1.307 1.841 -1.076 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 16 . 2336 . 1 1 6 VAL HG21 H -4.267 -0.792 0.089 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 16 . 2337 . 1 1 6 VAL HG22 H -4.577 0.383 -1.002 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 16 . 2338 . 1 1 6 VAL HG23 H -3.673 -0.909 -1.428 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 16 . 2339 . 1 1 6 VAL N N -0.384 0.180 0.722 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 16 . 2340 . 1 1 6 VAL O O -1.854 -2.532 -1.033 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 16 . 2341 . 1 1 7 GLY C C 1.006 -3.168 -2.319 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 16 . 2342 . 1 1 7 GLY CA C 0.195 -1.972 -2.778 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 16 . 2343 . 1 1 7 GLY H H 0.260 -0.265 -1.504 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 16 . 2344 . 1 1 7 GLY HA2 H -0.621 -2.301 -3.254 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 16 . 2345 . 1 1 7 GLY HA3 H 0.751 -1.429 -3.407 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 16 . 2346 . 1 1 7 GLY N N -0.218 -1.127 -1.673 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 16 . 2347 . 1 1 7 GLY O O 1.109 -4.167 -3.032 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 16 . 2348 . 1 1 8 HIS C C 1.504 -5.223 0.051 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 16 . 2349 . 1 1 8 HIS CA C 2.390 -4.151 -0.574 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 16 . 2350 . 1 1 8 HIS CB C 3.365 -3.607 0.472 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 16 . 2351 . 1 1 8 HIS CD2 C 4.160 -5.276 2.295 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2352 . 1 1 8 HIS CE1 C 5.888 -6.089 1.225 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2353 . 1 1 8 HIS CG C 4.243 -4.665 1.080 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 16 . 2354 . 1 1 8 HIS H H 1.462 -2.229 -0.594 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 16 . 2355 . 1 1 8 HIS HA H 2.901 -4.570 -1.324 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 16 . 2356 . 1 1 8 HIS HB2 H 3.951 -2.924 0.036 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2357 . 1 1 8 HIS HB3 H 2.838 -3.176 1.204 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2358 . 1 1 8 HIS HD2 H 3.471 -5.106 3.000 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2359 . 1 1 8 HIS HE1 H 6.701 -6.630 1.007 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2360 . 1 1 8 HIS HE2 H 5.436 -6.788 3.128 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2361 . 1 1 8 HIS N N 1.583 -3.067 -1.126 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 16 . 2362 . 1 1 8 HIS ND1 N 5.341 -5.192 0.419 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 16 . 2363 . 1 1 8 HIS NE2 N 5.208 -6.176 2.371 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2364 . 1 1 8 HIS O O 1.843 -6.408 0.040 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 16 . 2365 . 1 1 9 LEU C C -1.617 -6.206 0.229 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 16 . 2366 . 1 1 9 LEU CA C -0.568 -5.727 1.227 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 16 . 2367 . 1 1 9 LEU CB C -1.250 -5.057 2.421 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 16 . 2368 . 1 1 9 LEU CD1 C -1.160 -3.462 4.353 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 16 . 2369 . 1 1 9 LEU CD2 C 0.605 -5.216 4.099 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 16 . 2370 . 1 1 9 LEU CG C -0.337 -4.273 3.365 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 16 . 2371 . 1 1 9 LEU H H 0.147 -3.827 0.573 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 16 . 2372 . 1 1 9 LEU HA H -0.053 -6.523 1.546 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 16 . 2373 . 1 1 9 LEU HB2 H -1.937 -4.423 2.065 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2374 . 1 1 9 LEU HB3 H -1.701 -5.771 2.956 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2375 . 1 1 9 LEU HD11 H -1.740 -2.818 3.855 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 16 . 2376 . 1 1 9 LEU HD12 H -1.733 -4.077 4.894 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 16 . 2377 . 1 1 9 LEU HD13 H -0.547 -2.957 4.961 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 16 . 2378 . 1 1 9 LEU HD21 H 1.162 -5.707 3.429 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 16 . 2379 . 1 1 9 LEU HD22 H 1.201 -4.702 4.716 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 16 . 2380 . 1 1 9 LEU HD23 H 0.064 -5.871 4.627 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 16 . 2381 . 1 1 9 LEU HG H 0.236 -3.654 2.828 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 16 . 2382 . 1 1 9 LEU N N 0.367 -4.802 0.596 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 16 . 2383 . 1 1 9 LEU O O -1.754 -7.404 -0.015 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 16 . 2384 . 1 1 10 MET C C -2.831 -5.544 -2.740 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 16 . 2385 . 1 1 10 MET CA C -3.389 -5.586 -1.320 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 16 . 2386 . 1 1 10 MET CB C -4.563 -4.616 -1.192 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 16 . 2387 . 1 1 10 MET CE C -5.080 -6.696 2.020 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 16 . 2388 . 1 1 10 MET CG C -5.215 -4.628 0.181 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 16 . 2389 . 1 1 10 MET H H -2.193 -4.303 -0.105 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 16 . 2390 . 1 1 10 MET HA H -3.696 -6.520 -1.140 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 16 . 2391 . 1 1 10 MET HB2 H -4.231 -3.691 -1.376 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 16 . 2392 . 1 1 10 MET HB3 H -5.254 -4.863 -1.871 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 16 . 2393 . 1 1 10 MET HE1 H -4.111 -6.773 1.786 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 16 . 2394 . 1 1 10 MET HE2 H -5.197 -6.003 2.731 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 16 . 2395 . 1 1 10 MET HE3 H -5.413 -7.577 2.356 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 16 . 2396 . 1 1 10 MET HG2 H -4.511 -4.440 0.865 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 16 . 2397 . 1 1 10 MET HG3 H -5.906 -3.906 0.207 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 16 . 2398 . 1 1 10 MET N N -2.353 -5.260 -0.346 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 16 . 2399 . 1 1 10 MET O O -3.389 -6.152 -3.655 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 16 . 2400 . 1 1 10 MET SD S -6.000 -6.206 0.564 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 17 . 2401 . 1 1 1 GLY C C 1.451 8.800 -1.192 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 17 . 2402 . 1 1 1 GLY CA C 2.544 8.791 -2.243 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 17 . 2403 . 1 1 1 GLY H1 H 3.830 7.591 -1.254 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 17 . 2404 . 1 1 1 GLY H2 H 4.534 8.499 -2.415 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 17 . 2405 . 1 1 1 GLY H3 H 4.086 9.184 -1.002 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 17 . 2406 . 1 1 1 GLY HA2 H 2.579 9.691 -2.677 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 17 . 2407 . 1 1 1 GLY HA3 H 2.323 8.098 -2.929 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 17 . 2408 . 1 1 1 GLY N N 3.850 8.493 -1.685 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 17 . 2409 . 1 1 1 GLY O O 1.720 8.616 -0.006 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 17 . 2410 . 1 1 2 ASN C C -1.018 7.755 0.083 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 17 . 2411 . 1 1 2 ASN CA C -0.923 9.050 -0.718 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 17 . 2412 . 1 1 2 ASN CB C -2.220 9.279 -1.494 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 17 . 2413 . 1 1 2 ASN CG C -2.639 8.058 -2.292 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 17 . 2414 . 1 1 2 ASN H H 0.061 9.159 -2.607 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 17 . 2415 . 1 1 2 ASN HA H -0.747 9.784 -0.062 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 17 . 2416 . 1 1 2 ASN HB2 H -2.947 9.504 -0.845 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2417 . 1 1 2 ASN HB3 H -2.087 10.044 -2.124 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2418 . 1 1 2 ASN HD21 H -3.894 7.477 -0.817 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 17 . 2419 . 1 1 2 ASN HD22 H -3.848 6.439 -2.203 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 17 . 2420 . 1 1 2 ASN N N 0.215 9.016 -1.629 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 17 . 2421 . 1 1 2 ASN ND2 N -3.534 7.259 -1.724 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 17 . 2422 . 1 1 2 ASN O O -1.435 7.756 1.241 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 17 . 2423 . 1 1 2 ASN OD1 O -2.163 7.838 -3.406 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 17 . 2424 . 1 1 3 HIS C C 0.041 4.291 -0.735 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 17 . 2425 . 1 1 3 HIS CA C -0.667 5.346 0.111 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 17 . 2426 . 1 1 3 HIS CB C -2.112 4.923 0.366 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 17 . 2427 . 1 1 3 HIS CD2 C -1.443 3.144 2.137 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2428 . 1 1 3 HIS CE1 C -3.268 3.220 3.343 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2429 . 1 1 3 HIS CG C -2.289 4.059 1.584 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 17 . 2430 . 1 1 3 HIS H H -0.298 6.712 -1.485 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 17 . 2431 . 1 1 3 HIS HA H -0.182 5.421 0.982 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 17 . 2432 . 1 1 3 HIS HB2 H -2.667 5.747 0.483 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2433 . 1 1 3 HIS HB3 H -2.437 4.413 -0.430 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2434 . 1 1 3 HIS HD2 H -0.534 2.897 1.802 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2435 . 1 1 3 HIS HE1 H -3.940 3.033 4.059 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2436 . 1 1 3 HIS HE2 H -1.731 1.927 3.878 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2437 . 1 1 3 HIS N N -0.627 6.649 -0.543 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 17 . 2438 . 1 1 3 HIS ND1 N -3.436 4.093 2.360 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 17 . 2439 . 1 1 3 HIS NE2 N -2.077 2.622 3.248 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2440 . 1 1 3 HIS O O -0.519 3.784 -1.707 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 17 . 2441 . 1 1 4 TRP C C 1.967 1.612 -0.410 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 17 . 2442 . 1 1 4 TRP CA C 2.059 2.976 -1.084 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 17 . 2443 . 1 1 4 TRP CB C 3.520 3.418 -1.175 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 17 . 2444 . 1 1 4 TRP CD1 C 4.678 2.810 -3.378 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 17 . 2445 . 1 1 4 TRP CD2 C 4.945 1.296 -1.749 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2446 . 1 1 4 TRP CE2 C 5.625 0.844 -2.897 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2447 . 1 1 4 TRP CE3 C 4.973 0.506 -0.596 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 17 . 2448 . 1 1 4 TRP CG C 4.347 2.554 -2.078 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 17 . 2449 . 1 1 4 TRP CH2 C 6.334 -1.113 -1.780 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 17 . 2450 . 1 1 4 TRP CZ2 C 6.323 -0.360 -2.923 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 17 . 2451 . 1 1 4 TRP CZ3 C 5.666 -0.689 -0.624 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 17 . 2452 . 1 1 4 TRP H H 1.672 4.419 0.439 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 17 . 2453 . 1 1 4 TRP HA H 1.659 2.886 -1.996 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 17 . 2454 . 1 1 4 TRP HB2 H 3.549 4.355 -1.522 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2455 . 1 1 4 TRP HB3 H 3.920 3.390 -0.259 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2456 . 1 1 4 TRP HD1 H 4.402 3.622 -3.892 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 17 . 2457 . 1 1 4 TRP HE1 H 5.818 1.732 -4.804 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2458 . 1 1 4 TRP HE3 H 4.500 0.800 0.235 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 17 . 2459 . 1 1 4 TRP HH2 H 6.827 -1.983 -1.767 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 17 . 2460 . 1 1 4 TRP HZ2 H 6.798 -0.661 -3.750 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 17 . 2461 . 1 1 4 TRP HZ3 H 5.691 -1.261 0.196 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 17 . 2462 . 1 1 4 TRP N N 1.273 3.969 -0.360 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 17 . 2463 . 1 1 4 TRP NE1 N 5.447 1.785 -3.877 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2464 . 1 1 4 TRP O O 1.978 0.578 -1.077 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 17 . 2465 . 1 1 5 ALA C C 0.595 -0.460 1.218 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 17 . 2466 . 1 1 5 ALA CA C 1.781 0.379 1.678 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 17 . 2467 . 1 1 5 ALA CB C 1.669 0.684 3.166 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 17 . 2468 . 1 1 5 ALA H H 1.875 2.491 1.401 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 17 . 2469 . 1 1 5 ALA HA H 2.617 -0.149 1.528 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 17 . 2470 . 1 1 5 ALA HB1 H 0.852 1.236 3.330 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 17 . 2471 . 1 1 5 ALA HB2 H 1.604 -0.170 3.682 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2472 . 1 1 5 ALA HB3 H 2.479 1.191 3.462 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2473 . 1 1 5 ALA N N 1.877 1.617 0.915 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 17 . 2474 . 1 1 5 ALA O O 0.591 -1.682 1.364 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 17 . 2475 . 1 1 6 VAL C C -1.258 -1.492 -0.907 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 17 . 2476 . 1 1 6 VAL CA C -1.607 -0.481 0.177 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 17 . 2477 . 1 1 6 VAL CB C -2.639 0.516 -0.376 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 17 . 2478 . 1 1 6 VAL CG1 C -2.052 1.306 -1.537 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 17 . 2479 . 1 1 6 VAL CG2 C -3.905 -0.211 -0.805 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 17 . 2480 . 1 1 6 VAL H H -0.351 1.198 0.571 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 17 . 2481 . 1 1 6 VAL HA H -2.002 -0.984 0.946 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 17 . 2482 . 1 1 6 VAL HB H -2.854 1.166 0.353 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 17 . 2483 . 1 1 6 VAL HG11 H -1.787 0.682 -2.273 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 17 . 2484 . 1 1 6 VAL HG12 H -2.745 1.944 -1.874 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 17 . 2485 . 1 1 6 VAL HG13 H -1.250 1.818 -1.229 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 17 . 2486 . 1 1 6 VAL HG21 H -4.304 -0.684 -0.020 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 17 . 2487 . 1 1 6 VAL HG22 H -4.560 0.456 -1.160 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 17 . 2488 . 1 1 6 VAL HG23 H -3.686 -0.876 -1.519 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 17 . 2489 . 1 1 6 VAL N N -0.413 0.204 0.661 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 17 . 2490 . 1 1 6 VAL O O -1.890 -2.541 -1.021 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 17 . 2491 . 1 1 7 GLY C C 0.980 -3.235 -2.267 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 17 . 2492 . 1 1 7 GLY CA C 0.171 -2.059 -2.776 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 17 . 2493 . 1 1 7 GLY H H 0.233 -0.302 -1.572 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 17 . 2494 . 1 1 7 GLY HA2 H -0.644 -2.407 -3.240 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 17 . 2495 . 1 1 7 GLY HA3 H 0.729 -1.542 -3.425 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 17 . 2496 . 1 1 7 GLY N N -0.246 -1.169 -1.708 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 17 . 2497 . 1 1 7 GLY O O 1.013 -4.294 -2.895 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 17 . 2498 . 1 1 8 HIS C C 1.572 -5.168 0.122 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 17 . 2499 . 1 1 8 HIS CA C 2.451 -4.106 -0.532 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 17 . 2500 . 1 1 8 HIS CB C 3.413 -3.518 0.500 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 17 . 2501 . 1 1 8 HIS CD2 C 4.153 -5.331 2.207 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2502 . 1 1 8 HIS CE1 C 6.129 -5.746 1.365 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2503 . 1 1 8 HIS CG C 4.334 -4.537 1.115 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 17 . 2504 . 1 1 8 HIS H H 1.569 -2.169 -0.661 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 17 . 2505 . 1 1 8 HIS HA H 2.973 -4.544 -1.264 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 17 . 2506 . 1 1 8 HIS HB2 H 3.971 -2.819 0.052 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2507 . 1 1 8 HIS HB3 H 2.876 -3.097 1.231 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2508 . 1 1 8 HIS HD2 H 3.344 -5.360 2.794 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2509 . 1 1 8 HIS HE1 H 7.037 -6.140 1.226 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2510 . 1 1 8 HIS HE2 H 5.497 -6.776 3.052 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2511 . 1 1 8 HIS N N 1.636 -3.052 -1.125 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 17 . 2512 . 1 1 8 HIS ND1 N 5.588 -4.813 0.597 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 17 . 2513 . 1 1 8 HIS NE2 N 5.300 -6.091 2.351 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2514 . 1 1 8 HIS O O 1.890 -6.357 0.091 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 17 . 2515 . 1 1 9 LEU C C -1.516 -6.150 0.404 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 17 . 2516 . 1 1 9 LEU CA C -0.458 -5.642 1.379 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 17 . 2517 . 1 1 9 LEU CB C -1.131 -4.946 2.563 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 17 . 2518 . 1 1 9 LEU CD1 C -1.006 -3.366 4.505 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 17 . 2519 . 1 1 9 LEU CD2 C 0.699 -5.180 4.260 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 17 . 2520 . 1 1 9 LEU CG C -0.201 -4.200 3.521 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 17 . 2521 . 1 1 9 LEU H H 0.265 -3.751 0.708 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 17 . 2522 . 1 1 9 LEU HA H 0.063 -6.428 1.712 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 17 . 2523 . 1 1 9 LEU HB2 H -1.787 -4.285 2.198 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2524 . 1 1 9 LEU HB3 H -1.618 -5.642 3.091 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2525 . 1 1 9 LEU HD11 H -1.606 -3.964 5.036 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 17 . 2526 . 1 1 9 LEU HD12 H -0.382 -2.886 5.122 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 17 . 2527 . 1 1 9 LEU HD13 H -1.558 -2.699 4.004 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 17 . 2528 . 1 1 9 LEU HD21 H 0.130 -5.818 4.778 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 17 . 2529 . 1 1 9 LEU HD22 H 1.245 -5.687 3.593 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 17 . 2530 . 1 1 9 LEU HD23 H 1.307 -4.691 4.886 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 17 . 2531 . 1 1 9 LEU HG H 0.399 -3.598 2.993 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 17 . 2532 . 1 1 9 LEU N N 0.467 -4.730 0.716 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 17 . 2533 . 1 1 9 LEU O O -1.688 -7.356 0.234 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 17 . 2534 . 1 1 10 MET C C -3.030 -4.866 -2.527 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 17 . 2535 . 1 1 10 MET CA C -3.257 -5.574 -1.195 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 17 . 2536 . 1 1 10 MET CB C -4.638 -5.215 -0.642 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 17 . 2537 . 1 1 10 MET CE C -5.882 -3.393 1.989 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 17 . 2538 . 1 1 10 MET CG C -4.897 -3.719 -0.582 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 17 . 2539 . 1 1 10 MET H H -2.032 -4.255 -0.051 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 17 . 2540 . 1 1 10 MET HA H -3.199 -6.559 -1.359 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 17 . 2541 . 1 1 10 MET HB2 H -5.333 -5.633 -1.228 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 17 . 2542 . 1 1 10 MET HB3 H -4.715 -5.586 0.283 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 17 . 2543 . 1 1 10 MET HE1 H -5.539 -4.312 2.182 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 17 . 2544 . 1 1 10 MET HE2 H -5.149 -2.727 2.130 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 17 . 2545 . 1 1 10 MET HE3 H -6.644 -3.186 2.603 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 17 . 2546 . 1 1 10 MET HG2 H -4.130 -3.285 -0.109 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 17 . 2547 . 1 1 10 MET HG3 H -4.951 -3.371 -1.518 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 17 . 2548 . 1 1 10 MET N N -2.219 -5.220 -0.234 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 17 . 2549 . 1 1 10 MET O O -3.975 -4.600 -3.270 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 17 . 2550 . 1 1 10 MET SD S -6.427 -3.315 0.284 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 18 . 2551 . 1 1 1 GLY C C 1.037 9.432 -0.839 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 18 . 2552 . 1 1 1 GLY CA C 2.187 9.582 -1.815 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 18 . 2553 . 1 1 1 GLY H1 H 3.187 7.914 -1.277 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 18 . 2554 . 1 1 1 GLY H2 H 4.110 9.018 -2.048 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 18 . 2555 . 1 1 1 GLY H3 H 3.677 9.260 -0.493 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 18 . 2556 . 1 1 1 GLY HA2 H 2.398 10.554 -1.916 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 18 . 2557 . 1 1 1 GLY HA3 H 1.908 9.208 -2.700 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 18 . 2558 . 1 1 1 GLY N N 3.383 8.890 -1.374 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 18 . 2559 . 1 1 1 GLY O O 1.227 9.517 0.374 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 18 . 2560 . 1 1 2 ASN C C -1.294 7.732 0.238 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 18 . 2561 . 1 1 2 ASN CA C -1.348 9.045 -0.536 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 18 . 2562 . 1 1 2 ASN CB C -2.612 9.092 -1.397 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 18 . 2563 . 1 1 2 ASN CG C -2.804 10.437 -2.069 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 18 . 2564 . 1 1 2 ASN H H -0.251 9.147 -2.363 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 18 . 2565 . 1 1 2 ASN HA H -1.329 9.781 0.141 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 18 . 2566 . 1 1 2 ASN HB2 H -2.546 8.386 -2.103 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2567 . 1 1 2 ASN HB3 H -3.404 8.907 -0.815 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2568 . 1 1 2 ASN HD21 H -3.657 11.195 -0.398 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 18 . 2569 . 1 1 2 ASN HD22 H -3.531 12.294 -1.730 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 18 . 2570 . 1 1 2 ASN N N -0.161 9.207 -1.369 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 18 . 2571 . 1 1 2 ASN ND2 N -3.378 11.387 -1.339 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 18 . 2572 . 1 1 2 ASN O O -1.662 7.674 1.412 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 18 . 2573 . 1 1 2 ASN OD1 O -2.441 10.620 -3.232 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 18 . 2574 . 1 1 3 HIS C C 0.015 4.388 -0.707 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 18 . 2575 . 1 1 3 HIS CA C -0.729 5.364 0.198 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 18 . 2576 . 1 1 3 HIS CB C -2.119 4.818 0.521 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 18 . 2577 . 1 1 3 HIS CD2 C -1.189 3.069 2.201 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2578 . 1 1 3 HIS CE1 C -2.963 2.901 3.471 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2579 . 1 1 3 HIS CG C -2.152 3.900 1.713 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 18 . 2580 . 1 1 3 HIS H H -0.549 6.787 -1.381 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 18 . 2581 . 1 1 3 HIS HA H -0.205 5.464 1.044 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 18 . 2582 . 1 1 3 HIS HB2 H -2.728 5.590 0.703 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2583 . 1 1 3 HIS HB3 H -2.453 4.311 -0.274 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2584 . 1 1 3 HIS HD2 H -0.272 2.936 1.826 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2585 . 1 1 3 HIS HE1 H -3.583 2.616 4.202 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2586 . 1 1 3 HIS HE2 H -1.278 1.772 3.910 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2587 . 1 1 3 HIS N N -0.832 6.677 -0.428 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 18 . 2588 . 1 1 3 HIS ND1 N -3.265 3.781 2.528 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 18 . 2589 . 1 1 3 HIS NE2 N -1.720 2.444 3.315 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2590 . 1 1 3 HIS O O -0.516 3.942 -1.724 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 18 . 2591 . 1 1 4 TRP C C 2.054 1.746 -0.490 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 18 . 2592 . 1 1 4 TRP CA C 2.063 3.138 -1.111 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 18 . 2593 . 1 1 4 TRP CB C 3.499 3.655 -1.210 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 18 . 2594 . 1 1 4 TRP CD1 C 4.633 3.232 -3.471 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 18 . 2595 . 1 1 4 TRP CD2 C 5.001 1.637 -1.942 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2596 . 1 1 4 TRP CE2 C 5.674 1.286 -3.129 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2597 . 1 1 4 TRP CE3 C 5.089 0.782 -0.840 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 18 . 2598 . 1 1 4 TRP CG C 4.341 2.885 -2.181 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 18 . 2599 . 1 1 4 TRP CH2 C 6.492 -0.701 -2.147 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 18 . 2600 . 1 1 4 TRP CZ2 C 6.422 0.118 -3.242 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 18 . 2601 . 1 1 4 TRP CZ3 C 5.833 -0.377 -0.955 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 18 . 2602 . 1 1 4 TRP H H 1.623 4.457 0.507 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 18 . 2603 . 1 1 4 TRP HA H 1.646 3.063 -2.017 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 18 . 2604 . 1 1 4 TRP HB2 H 3.475 4.611 -1.502 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2605 . 1 1 4 TRP HB3 H 3.924 3.594 -0.307 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2606 . 1 1 4 TRP HD1 H 4.311 4.061 -3.929 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 18 . 2607 . 1 1 4 TRP HE1 H 5.786 2.295 -4.982 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2608 . 1 1 4 TRP HE3 H 4.623 1.004 0.016 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 18 . 2609 . 1 1 4 TRP HH2 H 7.023 -1.547 -2.197 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 18 . 2610 . 1 1 4 TRP HZ2 H 6.891 -0.112 -4.095 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 18 . 2611 . 1 1 4 TRP HZ3 H 5.901 -0.995 -0.172 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 18 . 2612 . 1 1 4 TRP N N 1.247 4.061 -0.331 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 18 . 2613 . 1 1 4 TRP NE1 N 5.434 2.275 -4.046 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2614 . 1 1 4 TRP O O 2.178 0.742 -1.193 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 18 . 2615 . 1 1 5 ALA C C 0.692 -0.430 1.104 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 18 . 2616 . 1 1 5 ALA CA C 1.879 0.420 1.543 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 18 . 2617 . 1 1 5 ALA CB C 1.832 0.660 3.046 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 18 . 2618 . 1 1 5 ALA H H 1.811 2.542 1.346 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 18 . 2619 . 1 1 5 ALA HA H 2.719 -0.079 1.330 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 18 . 2620 . 1 1 5 ALA HB1 H 1.010 1.182 3.272 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 18 . 2621 . 1 1 5 ALA HB2 H 1.814 -0.216 3.528 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2622 . 1 1 5 ALA HB3 H 2.642 1.176 3.324 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2623 . 1 1 5 ALA N N 1.906 1.691 0.830 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 18 . 2624 . 1 1 5 ALA O O 0.722 -1.656 1.207 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 18 . 2625 . 1 1 6 VAL C C -1.222 -1.454 -0.954 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 18 . 2626 . 1 1 6 VAL CA C -1.552 -0.468 0.159 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 18 . 2627 . 1 1 6 VAL CB C -2.618 0.521 -0.343 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 18 . 2628 . 1 1 6 VAL CG1 C -2.116 1.274 -1.567 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 18 . 2629 . 1 1 6 VAL CG2 C -3.918 -0.207 -0.653 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 18 . 2630 . 1 1 6 VAL H H -0.319 1.227 0.561 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 18 . 2631 . 1 1 6 VAL HA H -1.913 -0.991 0.931 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 18 . 2632 . 1 1 6 VAL HB H -2.774 1.193 0.381 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 18 . 2633 . 1 1 6 VAL HG11 H -1.911 0.628 -2.302 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 18 . 2634 . 1 1 6 VAL HG12 H -2.829 1.907 -1.869 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 18 . 2635 . 1 1 6 VAL HG13 H -1.290 1.788 -1.335 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 18 . 2636 . 1 1 6 VAL HG21 H -4.259 -0.654 0.174 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 18 . 2637 . 1 1 6 VAL HG22 H -4.594 0.455 -0.977 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 18 . 2638 . 1 1 6 VAL HG23 H -3.758 -0.894 -1.362 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 18 . 2639 . 1 1 6 VAL N N -0.354 0.229 0.616 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 18 . 2640 . 1 1 6 VAL O O -1.934 -2.438 -1.156 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 18 . 2641 . 1 1 7 GLY C C 1.267 -3.107 -2.319 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 18 . 2642 . 1 1 7 GLY CA C 0.265 -2.059 -2.762 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 18 . 2643 . 1 1 7 GLY H H 0.403 -0.372 -1.469 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 18 . 2644 . 1 1 7 GLY HA2 H -0.546 -2.521 -3.122 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 18 . 2645 . 1 1 7 GLY HA3 H 0.679 -1.503 -3.483 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 18 . 2646 . 1 1 7 GLY N N -0.140 -1.186 -1.676 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 18 . 2647 . 1 1 7 GLY O O 1.986 -3.675 -3.142 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 18 . 2648 . 1 1 8 HIS C C 1.478 -5.469 0.244 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 18 . 2649 . 1 1 8 HIS CA C 2.237 -4.352 -0.466 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 18 . 2650 . 1 1 8 HIS CB C 3.210 -3.684 0.508 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 18 . 2651 . 1 1 8 HIS CD2 C 4.256 -5.033 2.467 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2652 . 1 1 8 HIS CE1 C 5.790 -6.090 1.319 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2653 . 1 1 8 HIS CG C 4.160 -4.651 1.162 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 18 . 2654 . 1 1 8 HIS H H 0.704 -2.870 -0.398 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 18 . 2655 . 1 1 8 HIS HA H 2.746 -4.758 -1.225 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 18 . 2656 . 1 1 8 HIS HB2 H 3.746 -3.005 0.007 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2657 . 1 1 8 HIS HB3 H 2.681 -3.228 1.224 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2658 . 1 1 8 HIS HD2 H 3.685 -4.715 3.223 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2659 . 1 1 8 HIS HE1 H 6.553 -6.692 1.085 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2660 . 1 1 8 HIS HE2 H 5.628 -6.419 3.362 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2661 . 1 1 8 HIS N N 1.315 -3.365 -1.016 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 18 . 2662 . 1 1 8 HIS ND1 N 5.136 -5.329 0.451 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 18 . 2663 . 1 1 8 HIS NE2 N 5.293 -5.944 2.548 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2664 . 1 1 8 HIS O O 1.896 -6.627 0.227 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 18 . 2665 . 1 1 9 LEU C C -1.596 -6.593 0.706 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 18 . 2666 . 1 1 9 LEU CA C -0.458 -6.085 1.586 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 18 . 2667 . 1 1 9 LEU CB C -1.025 -5.462 2.863 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 18 . 2668 . 1 1 9 LEU CD1 C -0.711 -3.834 4.743 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 18 . 2669 . 1 1 9 LEU CD2 C 0.783 -5.832 4.559 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 18 . 2670 . 1 1 9 LEU CG C -0.010 -4.788 3.787 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 18 . 2671 . 1 1 9 LEU H H 0.072 -4.157 0.845 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 18 . 2672 . 1 1 9 LEU HA H 0.121 -6.863 1.829 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 18 . 2673 . 1 1 9 LEU HB2 H -1.699 -4.773 2.595 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2674 . 1 1 9 LEU HB3 H -1.478 -6.186 3.383 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2675 . 1 1 9 LEU HD11 H -1.369 -4.342 5.299 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 18 . 2676 . 1 1 9 LEU HD12 H -0.033 -3.403 5.338 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 18 . 2677 . 1 1 9 LEU HD13 H -1.191 -3.130 4.220 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 18 . 2678 . 1 1 9 LEU HD21 H 1.264 -6.421 3.910 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 18 . 2679 . 1 1 9 LEU HD22 H 1.446 -5.390 5.163 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 18 . 2680 . 1 1 9 LEU HD23 H 0.151 -6.383 5.104 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 18 . 2681 . 1 1 9 LEU HG H 0.647 -4.276 3.234 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 18 . 2682 . 1 1 9 LEU N N 0.360 -5.114 0.868 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 18 . 2683 . 1 1 9 LEU O O -1.666 -7.780 0.389 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 18 . 2684 . 1 1 10 MET C C -3.145 -6.483 -1.915 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 18 . 2685 . 1 1 10 MET CA C -3.616 -6.042 -0.533 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 18 . 2686 . 1 1 10 MET CB C -4.577 -4.857 -0.662 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 18 . 2687 . 1 1 10 MET CE C -6.780 -4.369 2.818 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 18 . 2688 . 1 1 10 MET CG C -5.025 -4.290 0.674 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 18 . 2689 . 1 1 10 MET H H -2.373 -4.735 0.605 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 18 . 2690 . 1 1 10 MET HA H -4.083 -6.817 -0.108 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 18 . 2691 . 1 1 10 MET HB2 H -4.118 -4.132 -1.175 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 18 . 2692 . 1 1 10 MET HB3 H -5.387 -5.159 -1.164 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 18 . 2693 . 1 1 10 MET HE1 H -6.073 -3.900 3.348 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 18 . 2694 . 1 1 10 MET HE2 H -7.330 -3.694 2.326 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 18 . 2695 . 1 1 10 MET HE3 H -7.367 -4.892 3.435 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 18 . 2696 . 1 1 10 MET HG2 H -4.211 -4.037 1.197 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 18 . 2697 . 1 1 10 MET HG3 H -5.577 -3.474 0.500 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 18 . 2698 . 1 1 10 MET N N -2.484 -5.685 0.313 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 18 . 2699 . 1 1 10 MET O O -3.880 -7.143 -2.651 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 18 . 2700 . 1 1 10 MET SD S -5.999 -5.464 1.636 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 19 . 2701 . 1 1 1 GLY C C -0.125 9.622 -2.067 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 19 . 2702 . 1 1 1 GLY CA C -0.535 10.115 -3.441 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 19 . 2703 . 1 1 1 GLY H1 H 1.327 10.372 -4.176 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 19 . 2704 . 1 1 1 GLY H2 H 0.180 11.219 -4.972 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 19 . 2705 . 1 1 1 GLY H3 H 0.691 11.717 -3.503 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 19 . 2706 . 1 1 1 GLY HA2 H -1.362 10.669 -3.350 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 19 . 2707 . 1 1 1 GLY HA3 H -0.726 9.324 -4.022 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 19 . 2708 . 1 1 1 GLY N N 0.496 10.918 -4.072 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 19 . 2709 . 1 1 1 GLY O O 1.043 9.318 -1.832 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 19 . 2710 . 1 1 2 ASN C C -1.224 7.625 0.374 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 19 . 2711 . 1 1 2 ASN CA C -0.823 9.087 0.203 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 19 . 2712 . 1 1 2 ASN CB C -1.577 9.955 1.212 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 19 . 2713 . 1 1 2 ASN CG C -1.173 9.660 2.644 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 19 . 2714 . 1 1 2 ASN H H -2.021 9.807 -1.408 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 19 . 2715 . 1 1 2 ASN HA H 0.167 9.132 0.334 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 19 . 2716 . 1 1 2 ASN HB2 H -1.385 10.916 1.015 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2717 . 1 1 2 ASN HB3 H -2.557 9.784 1.113 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2718 . 1 1 2 ASN HD21 H -3.024 8.961 3.064 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 19 . 2719 . 1 1 2 ASN HD22 H -1.901 8.925 4.382 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 19 . 2720 . 1 1 2 ASN N N -1.090 9.545 -1.156 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 19 . 2721 . 1 1 2 ASN ND2 N -2.110 9.139 3.428 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 19 . 2722 . 1 1 2 ASN O O -2.058 7.293 1.217 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 19 . 2723 . 1 1 2 ASN OD1 O -0.032 9.899 3.041 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 19 . 2724 . 1 1 3 HIS C C 0.179 4.517 -1.054 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 19 . 2725 . 1 1 3 HIS CA C -0.918 5.327 -0.370 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 19 . 2726 . 1 1 3 HIS CB C -2.268 5.032 -1.022 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 19 . 2727 . 1 1 3 HIS CD2 C -3.818 4.176 0.879 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2728 . 1 1 3 HIS CE1 C -5.202 5.870 0.923 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2729 . 1 1 3 HIS CG C -3.426 5.079 -0.063 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 19 . 2730 . 1 1 3 HIS H H 0.045 7.087 -1.097 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 19 . 2731 . 1 1 3 HIS HA H -0.948 5.058 0.593 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 19 . 2732 . 1 1 3 HIS HB2 H -2.428 5.709 -1.741 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2733 . 1 1 3 HIS HB3 H -2.232 4.118 -1.427 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2734 . 1 1 3 HIS HD2 H -3.376 3.304 1.087 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2735 . 1 1 3 HIS HE1 H -5.965 6.465 1.174 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2736 . 1 1 3 HIS HE2 H -5.481 4.283 2.231 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2737 . 1 1 3 HIS N N -0.624 6.755 -0.432 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 19 . 2738 . 1 1 3 HIS ND1 N -4.312 6.143 -0.021 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 19 . 2739 . 1 1 3 HIS NE2 N -4.943 4.693 1.494 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2740 . 1 1 3 HIS O O 0.244 4.455 -2.283 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 19 . 2741 . 1 1 4 TRP C C 2.038 1.653 -0.287 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 19 . 2742 . 1 1 4 TRP CA C 2.133 3.092 -0.782 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 19 . 2743 . 1 1 4 TRP CB C 3.479 3.695 -0.379 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 19 . 2744 . 1 1 4 TRP CD1 C 5.280 3.870 -2.194 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 19 . 2745 . 1 1 4 TRP CD2 C 5.251 1.909 -1.111 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2746 . 1 1 4 TRP CE2 C 6.277 1.875 -2.074 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2747 . 1 1 4 TRP CE3 C 5.044 0.785 -0.307 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 19 . 2748 . 1 1 4 TRP CG C 4.625 3.194 -1.204 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 19 . 2749 . 1 1 4 TRP CH2 C 6.867 -0.326 -1.453 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 19 . 2750 . 1 1 4 TRP CZ2 C 7.093 0.760 -2.253 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 19 . 2751 . 1 1 4 TRP CZ3 C 5.853 -0.320 -0.487 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 19 . 2752 . 1 1 4 TRP H H 0.930 3.986 0.737 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 19 . 2753 . 1 1 4 TRP HA H 2.036 3.072 -1.777 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 19 . 2754 . 1 1 4 TRP HB2 H 3.427 4.688 -0.482 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2755 . 1 1 4 TRP HB3 H 3.657 3.468 0.578 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2756 . 1 1 4 TRP HD1 H 5.068 4.801 -2.491 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 19 . 2757 . 1 1 4 TRP HE1 H 6.898 3.345 -3.459 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2758 . 1 1 4 TRP HE3 H 4.324 0.780 0.386 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 19 . 2759 . 1 1 4 TRP HH2 H 7.436 -1.142 -1.558 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 19 . 2760 . 1 1 4 TRP HZ2 H 7.817 0.758 -2.943 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 19 . 2761 . 1 1 4 TRP HZ3 H 5.711 -1.129 0.083 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 19 . 2762 . 1 1 4 TRP N N 1.037 3.898 -0.253 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 19 . 2763 . 1 1 4 TRP NE1 N 6.275 3.082 -2.722 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2764 . 1 1 4 TRP O O 2.008 0.714 -1.082 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 19 . 2765 . 1 1 5 ALA C C 0.655 -0.575 1.143 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 19 . 2766 . 1 1 5 ALA CA C 1.896 0.162 1.631 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 19 . 2767 . 1 1 5 ALA CB C 1.886 0.271 3.149 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 19 . 2768 . 1 1 5 ALA H H 2.019 2.291 1.625 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 19 . 2769 . 1 1 5 ALA HA H 2.702 -0.365 1.360 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 19 . 2770 . 1 1 5 ALA HB1 H 1.101 0.819 3.436 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 19 . 2771 . 1 1 5 ALA HB2 H 1.821 -0.642 3.553 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2772 . 1 1 5 ALA HB3 H 2.730 0.712 3.455 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2773 . 1 1 5 ALA N N 1.990 1.487 1.031 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 19 . 2774 . 1 1 5 ALA O O 0.616 -1.806 1.130 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 19 . 2775 . 1 1 6 VAL C C -1.339 -1.383 -0.883 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 19 . 2776 . 1 1 6 VAL CA C -1.604 -0.398 0.250 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 19 . 2777 . 1 1 6 VAL CB C -2.574 0.689 -0.243 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 19 . 2778 . 1 1 6 VAL CG1 C -2.001 1.407 -1.456 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 19 . 2779 . 1 1 6 VAL CG2 C -3.933 0.083 -0.567 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 19 . 2780 . 1 1 6 VAL H H -0.268 1.179 0.776 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 19 . 2781 . 1 1 6 VAL HA H -2.021 -0.906 1.004 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 19 . 2782 . 1 1 6 VAL HB H -2.672 1.364 0.489 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 19 . 2783 . 1 1 6 VAL HG11 H -1.852 0.754 -2.198 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 19 . 2784 . 1 1 6 VAL HG12 H -2.653 2.105 -1.752 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 19 . 2785 . 1 1 6 VAL HG13 H -1.133 1.841 -1.215 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 19 . 2786 . 1 1 6 VAL HG21 H -4.316 -0.342 0.253 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 19 . 2787 . 1 1 6 VAL HG22 H -4.546 0.806 -0.885 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 19 . 2788 . 1 1 6 VAL HG23 H -3.832 -0.607 -1.284 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 19 . 2789 . 1 1 6 VAL N N -0.360 0.184 0.741 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 19 . 2790 . 1 1 6 VAL O O -2.109 -2.318 -1.100 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 19 . 2791 . 1 1 7 GLY C C 0.921 -3.238 -2.265 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 19 . 2792 . 1 1 7 GLY CA C 0.103 -2.042 -2.709 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 19 . 2793 . 1 1 7 GLY H H 0.345 -0.388 -1.387 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 19 . 2794 . 1 1 7 GLY HA2 H -0.740 -2.370 -3.135 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 19 . 2795 . 1 1 7 GLY HA3 H 0.634 -1.521 -3.378 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 19 . 2796 . 1 1 7 GLY N N -0.245 -1.165 -1.606 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 19 . 2797 . 1 1 7 GLY O O 0.905 -4.285 -2.912 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 19 . 2798 . 1 1 8 HIS C C 1.615 -5.213 0.065 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 19 . 2799 . 1 1 8 HIS CA C 2.471 -4.158 -0.628 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 19 . 2800 . 1 1 8 HIS CB C 3.504 -3.598 0.353 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 19 . 2801 . 1 1 8 HIS CD2 C 4.443 -5.070 2.274 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2802 . 1 1 8 HIS CE1 C 5.869 -6.236 1.090 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2803 . 1 1 8 HIS CG C 4.370 -4.656 0.978 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 19 . 2804 . 1 1 8 HIS H H 1.613 -2.206 -0.677 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 19 . 2805 . 1 1 8 HIS HA H 2.940 -4.595 -1.395 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 19 . 2806 . 1 1 8 HIS HB2 H 4.094 -2.957 -0.138 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2807 . 1 1 8 HIS HB3 H 3.020 -3.114 1.083 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2808 . 1 1 8 HIS HD2 H 3.908 -4.717 3.042 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2809 . 1 1 8 HIS HE1 H 6.574 -6.899 0.836 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2810 . 1 1 8 HIS HE2 H 5.696 -6.589 3.131 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2811 . 1 1 8 HIS N N 1.641 -3.082 -1.158 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 19 . 2812 . 1 1 8 HIS ND1 N 5.277 -5.403 0.245 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 19 . 2813 . 1 1 8 HIS NE2 N 5.397 -6.071 2.329 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2814 . 1 1 8 HIS O O 1.974 -6.391 0.104 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 19 . 2815 . 1 1 9 LEU C C -1.522 -6.184 0.369 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 19 . 2816 . 1 1 9 LEU CA C -0.424 -5.692 1.305 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 19 . 2817 . 1 1 9 LEU CB C -1.046 -4.996 2.517 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 19 . 2818 . 1 1 9 LEU CD1 C -0.876 -3.277 4.335 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 19 . 2819 . 1 1 9 LEU CD2 C 0.873 -5.053 4.129 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 19 . 2820 . 1 1 9 LEU CG C -0.095 -4.157 3.371 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 19 . 2821 . 1 1 9 LEU H H 0.247 -3.814 0.547 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 19 . 2822 . 1 1 9 LEU HA H 0.102 -6.485 1.613 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 19 . 2823 . 1 1 9 LEU HB2 H -1.771 -4.392 2.185 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2824 . 1 1 9 LEU HB3 H -1.443 -5.701 3.105 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2825 . 1 1 9 LEU HD11 H -1.430 -3.852 4.937 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 19 . 2826 . 1 1 9 LEU HD12 H -0.238 -2.737 4.884 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 19 . 2827 . 1 1 9 LEU HD13 H -1.473 -2.664 3.818 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 19 . 2828 . 1 1 9 LEU HD21 H 1.402 -5.590 3.472 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 19 . 2829 . 1 1 9 LEU HD22 H 1.494 -4.503 4.687 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 19 . 2830 . 1 1 9 LEU HD23 H 0.352 -5.669 4.720 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 19 . 2831 . 1 1 9 LEU HG H 0.458 -3.578 2.772 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 19 . 2832 . 1 1 9 LEU N N 0.483 -4.784 0.612 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 19 . 2833 . 1 1 9 LEU O O -1.725 -7.388 0.214 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 19 . 2834 . 1 1 10 MET C C -2.780 -5.672 -2.612 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 19 . 2835 . 1 1 10 MET CA C -3.301 -5.584 -1.181 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 19 . 2836 . 1 1 10 MET CB C -4.421 -4.547 -1.096 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 19 . 2837 . 1 1 10 MET CE C -7.728 -4.393 0.031 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 19 . 2838 . 1 1 10 MET CG C -4.972 -4.359 0.309 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 19 . 2839 . 1 1 10 MET H H -2.011 -4.283 -0.088 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 19 . 2840 . 1 1 10 MET HA H -3.650 -6.486 -0.927 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 19 . 2841 . 1 1 10 MET HB2 H -4.065 -3.669 -1.415 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 19 . 2842 . 1 1 10 MET HB3 H -5.169 -4.839 -1.692 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 19 . 2843 . 1 1 10 MET HE1 H -7.582 -4.824 -0.859 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 19 . 2844 . 1 1 10 MET HE2 H -7.740 -5.095 0.743 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 19 . 2845 . 1 1 10 MET HE3 H -8.602 -3.908 0.027 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 19 . 2846 . 1 1 10 MET HG2 H -5.247 -5.254 0.661 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 19 . 2847 . 1 1 10 MET HG3 H -4.245 -3.984 0.884 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 19 . 2848 . 1 1 10 MET N N -2.225 -5.245 -0.256 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 19 . 2849 . 1 1 10 MET O O -3.076 -4.813 -3.444 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 19 . 2850 . 1 1 10 MET SD S -6.390 -3.248 0.357 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 . 20 . 2851 . 1 1 1 GLY C C 1.364 9.238 -1.235 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . c25525_2n0h 1 . 20 . 2852 . 1 1 1 GLY CA C 2.437 9.234 -2.306 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . c25525_2n0h 1 . 20 . 2853 . 1 1 1 GLY H1 H 3.887 8.369 -1.200 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . c25525_2n0h 1 . 20 . 2854 . 1 1 1 GLY H2 H 4.447 9.196 -2.492 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . c25525_2n0h 1 . 20 . 2855 . 1 1 1 GLY H3 H 3.920 10.001 -1.172 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . c25525_2n0h 1 . 20 . 2856 . 1 1 1 GLY HA2 H 2.342 10.062 -2.859 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 20 . 2857 . 1 1 1 GLY HA3 H 2.308 8.430 -2.886 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 20 . 2858 . 1 1 1 GLY N N 3.777 9.197 -1.749 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . c25525_2n0h 1 . 20 . 2859 . 1 1 1 GLY O O 1.665 9.336 -0.047 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . c25525_2n0h 1 . 20 . 2860 . 1 1 2 ASN C C -1.033 7.845 0.097 . . . 1.0 . . . . . . . . . . . . A . 2 ASN C . . . . . . . . . c25525_2n0h 1 . 20 . 2861 . 1 1 2 ASN CA C -1.014 9.130 -0.726 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CA . . . . . . . . . c25525_2n0h 1 . 20 . 2862 . 1 1 2 ASN CB C -2.334 9.282 -1.484 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CB . . . . . . . . . c25525_2n0h 1 . 20 . 2863 . 1 1 2 ASN CG C -2.516 8.217 -2.549 . . . 1.0 . . . . . . . . . . . . A . 2 ASN CG . . . . . . . . . c25525_2n0h 1 . 20 . 2864 . 1 1 2 ASN H H -0.072 9.057 -2.639 . . . 1.0 . . . . . . . . . . . . A . 2 ASN H . . . . . . . . . c25525_2n0h 1 . 20 . 2865 . 1 1 2 ASN HA H -0.861 9.882 -0.085 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HA . . . . . . . . . c25525_2n0h 1 . 20 . 2866 . 1 1 2 ASN HB2 H -3.088 9.216 -0.831 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2867 . 1 1 2 ASN HB3 H -2.351 10.181 -1.922 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2868 . 1 1 2 ASN HD21 H -1.666 9.410 -3.943 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD21 . . . . . . . . . c25525_2n0h 1 . 20 . 2869 . 1 1 2 ASN HD22 H -2.177 7.855 -4.509 . . . 1.0 . . . . . . . . . . . . A . 2 ASN HD22 . . . . . . . . . c25525_2n0h 1 . 20 . 2870 . 1 1 2 ASN N N 0.108 9.134 -1.658 . . . 1.0 . . . . . . . . . . . . A . 2 ASN N . . . . . . . . . c25525_2n0h 1 . 20 . 2871 . 1 1 2 ASN ND2 N -2.084 8.519 -3.767 . . . 1.0 . . . . . . . . . . . . A . 2 ASN ND2 . . . . . . . . . c25525_2n0h 1 . 20 . 2872 . 1 1 2 ASN O O -1.397 7.854 1.274 . . . 1.0 . . . . . . . . . . . . A . 2 ASN O . . . . . . . . . c25525_2n0h 1 . 20 . 2873 . 1 1 2 ASN OD1 O -3.038 7.135 -2.278 . . . 1.0 . . . . . . . . . . . . A . 2 ASN OD1 . . . . . . . . . c25525_2n0h 1 . 20 . 2874 . 1 1 3 HIS C C 0.039 4.389 -0.742 . . . 1.0 . . . . . . . . . . . . A . 3 HIS C . . . . . . . . . c25525_2n0h 1 . 20 . 2875 . 1 1 3 HIS CA C -0.607 5.448 0.145 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CA . . . . . . . . . c25525_2n0h 1 . 20 . 2876 . 1 1 3 HIS CB C -2.020 5.015 0.527 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CB . . . . . . . . . c25525_2n0h 1 . 20 . 2877 . 1 1 3 HIS CD2 C -1.213 3.136 2.129 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2878 . 1 1 3 HIS CE1 C -2.855 3.248 3.573 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2879 . 1 1 3 HIS CG C -2.077 4.111 1.728 . . . 1.0 . . . . . . . . . . . . A . 3 HIS CG . . . . . . . . . c25525_2n0h 1 . 20 . 2880 . 1 1 3 HIS H H -0.353 6.799 -1.486 . . . 1.0 . . . . . . . . . . . . A . 3 HIS H . . . . . . . . . c25525_2n0h 1 . 20 . 2881 . 1 1 3 HIS HA H -0.051 5.541 0.971 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HA . . . . . . . . . c25525_2n0h 1 . 20 . 2882 . 1 1 3 HIS HB2 H -2.559 5.834 0.725 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2883 . 1 1 3 HIS HB3 H -2.423 4.530 -0.249 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2884 . 1 1 3 HIS HD2 H -0.371 2.860 1.665 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2885 . 1 1 3 HIS HE1 H -3.435 3.063 4.367 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2886 . 1 1 3 HIS HE2 H -1.328 1.865 3.853 . . . 1.0 . . . . . . . . . . . . A . 3 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2887 . 1 1 3 HIS N N -0.637 6.741 -0.529 . . . 1.0 . . . . . . . . . . . . A . 3 HIS N . . . . . . . . . c25525_2n0h 1 . 20 . 2888 . 1 1 3 HIS ND1 N -3.107 4.167 2.652 . . . 1.0 . . . . . . . . . . . . A . 3 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 20 . 2889 . 1 1 3 HIS NE2 N -1.719 2.600 3.298 . . . 1.0 . . . . . . . . . . . . A . 3 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2890 . 1 1 3 HIS O O -0.551 3.947 -1.728 . . . 1.0 . . . . . . . . . . . . A . 3 HIS O . . . . . . . . . c25525_2n0h 1 . 20 . 2891 . 1 1 4 TRP C C 1.931 1.624 -0.448 . . . 1.0 . . . . . . . . . . . . A . 4 TRP C . . . . . . . . . c25525_2n0h 1 . 20 . 2892 . 1 1 4 TRP CA C 1.980 2.977 -1.148 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CA . . . . . . . . . c25525_2n0h 1 . 20 . 2893 . 1 1 4 TRP CB C 3.433 3.410 -1.350 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CB . . . . . . . . . c25525_2n0h 1 . 20 . 2894 . 1 1 4 TRP CD1 C 4.568 2.444 -3.436 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD1 . . . . . . . . . c25525_2n0h 1 . 20 . 2895 . 1 1 4 TRP CD2 C 4.854 1.222 -1.582 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2896 . 1 1 4 TRP CE2 C 5.522 0.587 -2.648 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2897 . 1 1 4 TRP CE3 C 4.896 0.634 -0.315 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CE3 . . . . . . . . . c25525_2n0h 1 . 20 . 2898 . 1 1 4 TRP CG C 4.251 2.408 -2.107 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CG . . . . . . . . . c25525_2n0h 1 . 20 . 2899 . 1 1 4 TRP CH2 C 6.247 -1.159 -1.231 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CH2 . . . . . . . . . c25525_2n0h 1 . 20 . 2900 . 1 1 4 TRP CZ2 C 6.222 -0.606 -2.482 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ2 . . . . . . . . . c25525_2n0h 1 . 20 . 2901 . 1 1 4 TRP CZ3 C 5.591 -0.550 -0.153 . . . 1.0 . . . . . . . . . . . . A . 4 TRP CZ3 . . . . . . . . . c25525_2n0h 1 . 20 . 2902 . 1 1 4 TRP H H 1.681 4.382 0.427 . . . 1.0 . . . . . . . . . . . . A . 4 TRP H . . . . . . . . . c25525_2n0h 1 . 20 . 2903 . 1 1 4 TRP HA H 1.514 2.875 -2.027 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HA . . . . . . . . . c25525_2n0h 1 . 20 . 2904 . 1 1 4 TRP HB2 H 3.442 4.272 -1.857 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2905 . 1 1 4 TRP HB3 H 3.853 3.547 -0.453 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2906 . 1 1 4 TRP HD1 H 4.285 3.160 -4.074 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HD1 . . . . . . . . . c25525_2n0h 1 . 20 . 2907 . 1 1 4 TRP HE1 H 5.692 1.147 -4.677 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2908 . 1 1 4 TRP HE3 H 4.432 1.061 0.461 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HE3 . . . . . . . . . c25525_2n0h 1 . 20 . 2909 . 1 1 4 TRP HH2 H 6.742 -2.014 -1.080 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HH2 . . . . . . . . . c25525_2n0h 1 . 20 . 2910 . 1 1 4 TRP HZ2 H 6.688 -1.039 -3.253 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ2 . . . . . . . . . c25525_2n0h 1 . 20 . 2911 . 1 1 4 TRP HZ3 H 5.626 -0.979 0.750 . . . 1.0 . . . . . . . . . . . . A . 4 TRP HZ3 . . . . . . . . . c25525_2n0h 1 . 20 . 2912 . 1 1 4 TRP N N 1.254 3.985 -0.385 . . . 1.0 . . . . . . . . . . . . A . 4 TRP N . . . . . . . . . c25525_2n0h 1 . 20 . 2913 . 1 1 4 TRP NE1 N 5.332 1.352 -3.767 . . . 1.0 . . . . . . . . . . . . A . 4 TRP NE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2914 . 1 1 4 TRP O O 1.979 0.578 -1.095 . . . 1.0 . . . . . . . . . . . . A . 4 TRP O . . . . . . . . . c25525_2n0h 1 . 20 . 2915 . 1 1 5 ALA C C 0.614 -0.452 1.229 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . c25525_2n0h 1 . 20 . 2916 . 1 1 5 ALA CA C 1.781 0.426 1.665 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . c25525_2n0h 1 . 20 . 2917 . 1 1 5 ALA CB C 1.673 0.756 3.147 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . c25525_2n0h 1 . 20 . 2918 . 1 1 5 ALA H H 1.806 2.535 1.347 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . c25525_2n0h 1 . 20 . 2919 . 1 1 5 ALA HA H 2.629 -0.082 1.518 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . c25525_2n0h 1 . 20 . 2920 . 1 1 5 ALA HB1 H 0.842 1.289 3.308 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . c25525_2n0h 1 . 20 . 2921 . 1 1 5 ALA HB2 H 1.634 -0.090 3.679 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2922 . 1 1 5 ALA HB3 H 2.471 1.290 3.426 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2923 . 1 1 5 ALA N N 1.838 1.652 0.878 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . c25525_2n0h 1 . 20 . 2924 . 1 1 5 ALA O O 0.650 -1.673 1.386 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . c25525_2n0h 1 . 20 . 2925 . 1 1 6 VAL C C -1.251 -1.506 -0.908 . . . 1.0 . . . . . . . . . . . . A . 6 VAL C . . . . . . . . . c25525_2n0h 1 . 20 . 2926 . 1 1 6 VAL CA C -1.603 -0.550 0.224 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CA . . . . . . . . . c25525_2n0h 1 . 20 . 2927 . 1 1 6 VAL CB C -2.702 0.414 -0.253 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CB . . . . . . . . . c25525_2n0h 1 . 20 . 2928 . 1 1 6 VAL CG1 C -2.193 1.285 -1.393 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG1 . . . . . . . . . c25525_2n0h 1 . 20 . 2929 . 1 1 6 VAL CG2 C -3.942 -0.359 -0.677 . . . 1.0 . . . . . . . . . . . . A . 6 VAL CG2 . . . . . . . . . c25525_2n0h 1 . 20 . 2930 . 1 1 6 VAL H H -0.394 1.171 0.584 . . . 1.0 . . . . . . . . . . . . A . 6 VAL H . . . . . . . . . c25525_2n0h 1 . 20 . 2931 . 1 1 6 VAL HA H -1.941 -1.097 0.990 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HA . . . . . . . . . c25525_2n0h 1 . 20 . 2932 . 1 1 6 VAL HB H -2.928 1.019 0.511 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HB . . . . . . . . . c25525_2n0h 1 . 20 . 2933 . 1 1 6 VAL HG11 H -1.919 0.710 -2.164 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG11 . . . . . . . . . c25525_2n0h 1 . 20 . 2934 . 1 1 6 VAL HG12 H -2.928 1.899 -1.680 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG12 . . . . . . . . . c25525_2n0h 1 . 20 . 2935 . 1 1 6 VAL HG13 H -1.410 1.824 -1.084 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG13 . . . . . . . . . c25525_2n0h 1 . 20 . 2936 . 1 1 6 VAL HG21 H -4.291 -0.886 0.098 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG21 . . . . . . . . . c25525_2n0h 1 . 20 . 2937 . 1 1 6 VAL HG22 H -4.642 0.287 -0.983 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG22 . . . . . . . . . c25525_2n0h 1 . 20 . 2938 . 1 1 6 VAL HG23 H -3.712 -0.980 -1.426 . . . 1.0 . . . . . . . . . . . . A . 6 VAL HG23 . . . . . . . . . c25525_2n0h 1 . 20 . 2939 . 1 1 6 VAL N N -0.423 0.176 0.683 . . . 1.0 . . . . . . . . . . . . A . 6 VAL N . . . . . . . . . c25525_2n0h 1 . 20 . 2940 . 1 1 6 VAL O O -1.911 -2.528 -1.099 . . . 1.0 . . . . . . . . . . . . A . 6 VAL O . . . . . . . . . c25525_2n0h 1 . 20 . 2941 . 1 1 7 GLY C C 1.275 -3.013 -2.361 . . . 1.0 . . . . . . . . . . . . A . 7 GLY C . . . . . . . . . c25525_2n0h 1 . 20 . 2942 . 1 1 7 GLY CA C 0.213 -2.010 -2.766 . . . 1.0 . . . . . . . . . . . . A . 7 GLY CA . . . . . . . . . c25525_2n0h 1 . 20 . 2943 . 1 1 7 GLY H H 0.293 -0.328 -1.461 . . . 1.0 . . . . . . . . . . . . A . 7 GLY H . . . . . . . . . c25525_2n0h 1 . 20 . 2944 . 1 1 7 GLY HA2 H -0.583 -2.507 -3.112 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA2 . . . . . . . . . c25525_2n0h 1 . 20 . 2945 . 1 1 7 GLY HA3 H 0.582 -1.427 -3.490 . . . 1.0 . . . . . . . . . . . . A . 7 GLY HA3 . . . . . . . . . c25525_2n0h 1 . 20 . 2946 . 1 1 7 GLY N N -0.208 -1.170 -1.660 . . . 1.0 . . . . . . . . . . . . A . 7 GLY N . . . . . . . . . c25525_2n0h 1 . 20 . 2947 . 1 1 7 GLY O O 1.998 -3.539 -3.208 . . . 1.0 . . . . . . . . . . . . A . 7 GLY O . . . . . . . . . c25525_2n0h 1 . 20 . 2948 . 1 1 8 HIS C C 1.667 -5.388 0.166 . . . 1.0 . . . . . . . . . . . . A . 8 HIS C . . . . . . . . . c25525_2n0h 1 . 20 . 2949 . 1 1 8 HIS CA C 2.353 -4.226 -0.546 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CA . . . . . . . . . c25525_2n0h 1 . 20 . 2950 . 1 1 8 HIS CB C 3.315 -3.523 0.413 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CB . . . . . . . . . c25525_2n0h 1 . 20 . 2951 . 1 1 8 HIS CD2 C 4.495 -4.988 2.205 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2952 . 1 1 8 HIS CE1 C 6.204 -5.624 0.993 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2953 . 1 1 8 HIS CG C 4.380 -4.430 0.967 . . . 1.0 . . . . . . . . . . . . A . 8 HIS CG . . . . . . . . . c25525_2n0h 1 . 20 . 2954 . 1 1 8 HIS H H 0.755 -2.819 -0.423 . . . 1.0 . . . . . . . . . . . . A . 8 HIS H . . . . . . . . . c25525_2n0h 1 . 20 . 2955 . 1 1 8 HIS HA H 2.864 -4.596 -1.322 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HA . . . . . . . . . c25525_2n0h 1 . 20 . 2956 . 1 1 8 HIS HB2 H 3.762 -2.775 -0.077 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2957 . 1 1 8 HIS HB3 H 2.788 -3.153 1.178 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2958 . 1 1 8 HIS HD2 H 3.861 -4.875 2.970 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2959 . 1 1 8 HIS HE1 H 7.055 -6.067 0.712 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2960 . 1 1 8 HIS HE2 H 6.034 -6.281 2.957 . . . 1.0 . . . . . . . . . . . . A . 8 HIS HE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2961 . 1 1 8 HIS N N 1.371 -3.279 -1.062 . . . 1.0 . . . . . . . . . . . . A . 8 HIS N . . . . . . . . . c25525_2n0h 1 . 20 . 2962 . 1 1 8 HIS ND1 N 5.468 -4.843 0.216 . . . 1.0 . . . . . . . . . . . . A . 8 HIS ND1 . . . . . . . . . c25525_2n0h 1 . 20 . 2963 . 1 1 8 HIS NE2 N 5.655 -5.741 2.205 . . . 1.0 . . . . . . . . . . . . A . 8 HIS NE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2964 . 1 1 8 HIS O O 2.114 -6.532 0.085 . . . 1.0 . . . . . . . . . . . . A . 8 HIS O . . . . . . . . . c25525_2n0h 1 . 20 . 2965 . 1 1 9 LEU C C -1.302 -6.663 0.739 . . . 1.0 . . . . . . . . . . . . A . 9 LEU C . . . . . . . . . c25525_2n0h 1 . 20 . 2966 . 1 1 9 LEU CA C -0.170 -6.105 1.594 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CA . . . . . . . . . c25525_2n0h 1 . 20 . 2967 . 1 1 9 LEU CB C -0.734 -5.522 2.891 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CB . . . . . . . . . c25525_2n0h 1 . 20 . 2968 . 1 1 9 LEU CD1 C -0.500 -3.939 4.821 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD1 . . . . . . . . . c25525_2n0h 1 . 20 . 2969 . 1 1 9 LEU CD2 C 1.279 -5.641 4.379 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CD2 . . . . . . . . . c25525_2n0h 1 . 20 . 2970 . 1 1 9 LEU CG C 0.244 -4.720 3.749 . . . 1.0 . . . . . . . . . . . . A . 9 LEU CG . . . . . . . . . c25525_2n0h 1 . 20 . 2971 . 1 1 9 LEU H H 0.264 -4.137 0.894 . . . 1.0 . . . . . . . . . . . . A . 9 LEU H . . . . . . . . . c25525_2n0h 1 . 20 . 2972 . 1 1 9 LEU HA H 0.455 -6.855 1.814 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HA . . . . . . . . . c25525_2n0h 1 . 20 . 2973 . 1 1 9 LEU HB2 H -1.494 -4.919 2.650 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2974 . 1 1 9 LEU HB3 H -1.074 -6.281 3.446 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2975 . 1 1 9 LEU HD11 H -1.143 -3.308 4.388 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD11 . . . . . . . . . c25525_2n0h 1 . 20 . 2976 . 1 1 9 LEU HD12 H -1.001 -4.574 5.409 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD12 . . . . . . . . . c25525_2n0h 1 . 20 . 2977 . 1 1 9 LEU HD13 H 0.156 -3.422 5.371 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD13 . . . . . . . . . c25525_2n0h 1 . 20 . 2978 . 1 1 9 LEU HD21 H 1.781 -6.111 3.653 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD21 . . . . . . . . . c25525_2n0h 1 . 20 . 2979 . 1 1 9 LEU HD22 H 1.918 -5.115 4.940 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD22 . . . . . . . . . c25525_2n0h 1 . 20 . 2980 . 1 1 9 LEU HD23 H 0.810 -6.315 4.950 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HD23 . . . . . . . . . c25525_2n0h 1 . 20 . 2981 . 1 1 9 LEU HG H 0.744 -4.081 3.165 . . . 1.0 . . . . . . . . . . . . A . 9 LEU HG . . . . . . . . . c25525_2n0h 1 . 20 . 2982 . 1 1 9 LEU N N 0.578 -5.086 0.866 . . . 1.0 . . . . . . . . . . . . A . 9 LEU N . . . . . . . . . c25525_2n0h 1 . 20 . 2983 . 1 1 9 LEU O O -1.295 -7.838 0.372 . . . 1.0 . . . . . . . . . . . . A . 9 LEU O . . . . . . . . . c25525_2n0h 1 . 20 . 2984 . 1 1 10 MET C C -3.810 -5.114 -1.363 . . . 1.0 . . . . . . . . . . . . A . 10 MET C . . . . . . . . . c25525_2n0h 1 . 20 . 2985 . 1 1 10 MET CA C -3.411 -6.221 -0.393 . . . 1.0 . . . . . . . . . . . . A . 10 MET CA . . . . . . . . . c25525_2n0h 1 . 20 . 2986 . 1 1 10 MET CB C -4.600 -6.587 0.498 . . . 1.0 . . . . . . . . . . . . A . 10 MET CB . . . . . . . . . c25525_2n0h 1 . 20 . 2987 . 1 1 10 MET CE C -5.116 -6.893 3.954 . . . 1.0 . . . . . . . . . . . . A . 10 MET CE . . . . . . . . . c25525_2n0h 1 . 20 . 2988 . 1 1 10 MET CG C -4.920 -5.533 1.546 . . . 1.0 . . . . . . . . . . . . A . 10 MET CG . . . . . . . . . c25525_2n0h 1 . 20 . 2989 . 1 1 10 MET H H -2.222 -4.870 0.753 . . . 1.0 . . . . . . . . . . . . A . 10 MET H . . . . . . . . . c25525_2n0h 1 . 20 . 2990 . 1 1 10 MET HA H -3.131 -7.014 -0.933 . . . 1.0 . . . . . . . . . . . . A . 10 MET HA . . . . . . . . . c25525_2n0h 1 . 20 . 2991 . 1 1 10 MET HB2 H -5.405 -6.710 -0.082 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB2 . . . . . . . . . c25525_2n0h 1 . 20 . 2992 . 1 1 10 MET HB3 H -4.393 -7.446 0.967 . . . 1.0 . . . . . . . . . . . . A . 10 MET HB3 . . . . . . . . . c25525_2n0h 1 . 20 . 2993 . 1 1 10 MET HE1 H -4.612 -7.637 3.516 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE1 . . . . . . . . . c25525_2n0h 1 . 20 . 2994 . 1 1 10 MET HE2 H -4.470 -6.226 4.325 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE2 . . . . . . . . . c25525_2n0h 1 . 20 . 2995 . 1 1 10 MET HE3 H -5.677 -7.261 4.696 . . . 1.0 . . . . . . . . . . . . A . 10 MET HE3 . . . . . . . . . c25525_2n0h 1 . 20 . 2996 . 1 1 10 MET HG2 H -4.077 -5.308 2.034 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG2 . . . . . . . . . c25525_2n0h 1 . 20 . 2997 . 1 1 10 MET HG3 H -5.262 -4.718 1.078 . . . 1.0 . . . . . . . . . . . . A . 10 MET HG3 . . . . . . . . . c25525_2n0h 1 . 20 . 2998 . 1 1 10 MET N N -2.273 -5.813 0.423 . . . 1.0 . . . . . . . . . . . . A . 10 MET N . . . . . . . . . c25525_2n0h 1 . 20 . 2999 . 1 1 10 MET O O -4.241 -4.037 -0.949 . . . 1.0 . . . . . . . . . . . . A . 10 MET O . . . . . . . . . c25525_2n0h 1 . 20 . 3000 . 1 1 10 MET SD S -6.156 -6.090 2.736 . . . 1.0 . . . . . . . . . . . . A . 10 MET SD . . . . . . . . . c25525_2n0h 1 stop_ save_ ########################### # Constraint Statistics # ########################### save_constraint_statistics _Constraint_stat_list.Sf_framecode constraint_statistics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID c25525_2n0h _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 2n0h.mr . . 'MR format' 1 comment 'Not applicable' 'Not applicable' 0 c25525_2n0h 1 1 2n0h.mr . . DYANA/DIANA 2 distance NOE simple 138 c25525_2n0h 1 1 2n0h.mr . . 'MR format' 3 'nomenclature mapping' 'Not applicable' 'Not applicable' 0 c25525_2n0h 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Sf_category general_distance_constraints _Gen_dist_constraint_list.Sf_framecode DYANA/DIANA_distance_constraints_2 _Gen_dist_constraint_list.Entry_ID c25525_2n0h _Gen_dist_constraint_list.ID 1 _Gen_dist_constraint_list.Constraint_type NOE _Gen_dist_constraint_list.Details 'Generated by Wattos' _Gen_dist_constraint_list.Constraint_file_ID 1 _Gen_dist_constraint_list.Block_ID 2 loop_ _Gen_dist_constraint_software.Software_ID _Gen_dist_constraint_software.Software_label _Gen_dist_constraint_software.Method_ID _Gen_dist_constraint_software.Method_label _Gen_dist_constraint_software.Entry_ID _Gen_dist_constraint_software.Gen_dist_constraint_list_ID . . . . c25525_2n0h 1 stop_ loop_ _Gen_dist_constraint.ID _Gen_dist_constraint.Member_ID _Gen_dist_constraint.Member_logic_code _Gen_dist_constraint.Assembly_atom_ID_1 _Gen_dist_constraint.Entity_assembly_ID_1 _Gen_dist_constraint.Entity_ID_1 _Gen_dist_constraint.Comp_index_ID_1 _Gen_dist_constraint.Seq_ID_1 _Gen_dist_constraint.Comp_ID_1 _Gen_dist_constraint.Atom_ID_1 _Gen_dist_constraint.Atom_type_1 _Gen_dist_constraint.Atom_isotope_number_1 _Gen_dist_constraint.Resonance_ID_1 _Gen_dist_constraint.Assembly_atom_ID_2 _Gen_dist_constraint.Entity_assembly_ID_2 _Gen_dist_constraint.Entity_ID_2 _Gen_dist_constraint.Comp_index_ID_2 _Gen_dist_constraint.Seq_ID_2 _Gen_dist_constraint.Comp_ID_2 _Gen_dist_constraint.Atom_ID_2 _Gen_dist_constraint.Atom_type_2 _Gen_dist_constraint.Atom_isotope_number_2 _Gen_dist_constraint.Resonance_ID_2 _Gen_dist_constraint.Intensity_val _Gen_dist_constraint.Intensity_lower_val_err _Gen_dist_constraint.Intensity_upper_val_err _Gen_dist_constraint.Distance_val _Gen_dist_constraint.Distance_lower_bound_val _Gen_dist_constraint.Distance_upper_bound_val _Gen_dist_constraint.Contribution_fractional_val _Gen_dist_constraint.Spectral_peak_ID _Gen_dist_constraint.Spectral_peak_list_ID _Gen_dist_constraint.PDB_record_ID_1 _Gen_dist_constraint.PDB_model_num_1 _Gen_dist_constraint.PDB_strand_ID_1 _Gen_dist_constraint.PDB_ins_code_1 _Gen_dist_constraint.PDB_residue_no_1 _Gen_dist_constraint.PDB_residue_name_1 _Gen_dist_constraint.PDB_atom_name_1 _Gen_dist_constraint.PDB_record_ID_2 _Gen_dist_constraint.PDB_model_num_2 _Gen_dist_constraint.PDB_strand_ID_2 _Gen_dist_constraint.PDB_ins_code_2 _Gen_dist_constraint.PDB_residue_no_2 _Gen_dist_constraint.PDB_residue_name_2 _Gen_dist_constraint.PDB_atom_name_2 _Gen_dist_constraint.Auth_entity_assembly_ID_1 _Gen_dist_constraint.Auth_asym_ID_1 _Gen_dist_constraint.Auth_chain_ID_1 _Gen_dist_constraint.Auth_seq_ID_1 _Gen_dist_constraint.Auth_comp_ID_1 _Gen_dist_constraint.Auth_atom_ID_1 _Gen_dist_constraint.Auth_alt_ID_1 _Gen_dist_constraint.Auth_atom_name_1 _Gen_dist_constraint.Auth_entity_assembly_ID_2 _Gen_dist_constraint.Auth_asym_ID_2 _Gen_dist_constraint.Auth_chain_ID_2 _Gen_dist_constraint.Auth_seq_ID_2 _Gen_dist_constraint.Auth_comp_ID_2 _Gen_dist_constraint.Auth_atom_ID_2 _Gen_dist_constraint.Auth_alt_ID_2 _Gen_dist_constraint.Auth_atom_name_2 _Gen_dist_constraint.Entry_ID _Gen_dist_constraint.Gen_dist_constraint_list_ID 1 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG1 H . . . . . . . 3.14 . . . . . A . 6 VAL H . . A . 6 VAL MG1 . . . 6 VAL H . . . . . 6 VAL QG1 . . c25525_2n0h 1 2 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL HB H . . . . . . . 3.21 . . . . . A . 6 VAL H . . A . 6 VAL HB . . . 6 VAL H . . . . . 6 VAL HB . . c25525_2n0h 1 3 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB3 H . . . . . . . 3.38 . . . . . A . 4 TRP H . . A . 4 TRP HB3 . . . 4 TRP H . . . . . 4 TRP HB3 . . c25525_2n0h 1 4 1 OR . 1 1 3 3 HIS H H . . . 1 1 3 3 HIS HB2 H . . . . . . . 3.29 . . . . . A . 3 HIS H . . A . 3 HIS HB2 . . . 3 HIS H . . . . . 3 HIS QB . . c25525_2n0h 1 4 2 OR . 1 1 3 3 HIS H H . . . 1 1 3 3 HIS HB3 H . . . . . . . 3.29 . . . . . A . 3 HIS H . . A . 3 HIS HB3 . . . 3 HIS H . . . . . 3 HIS QB . . c25525_2n0h 1 5 1 . . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB2 H . . . . . . . 3.84 . . . . . A . 2 ASN H . . A . 2 ASN HB2 . . . 2 ASN H . . . . . 2 ASN HB2 . . c25525_2n0h 1 6 1 . . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB3 H . . . . . . . 3.84 . . . . . A . 2 ASN H . . A . 2 ASN HB3 . . . 2 ASN H . . . . . 2 ASN HB3 . . c25525_2n0h 1 7 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB2 H . . . . . . . 3.27 . . . . . A . 9 LEU H . . A . 9 LEU HB2 . . . 9 LEU H . . . . . 9 LEU HB2 . . c25525_2n0h 1 8 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HB3 H . . . . . . . 3.86 . . . . . A . 9 LEU H . . A . 9 LEU HB3 . . . 9 LEU H . . . . . 9 LEU HB3 . . c25525_2n0h 1 9 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.63 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS HB2 . . c25525_2n0h 1 10 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.63 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS HB3 . . c25525_2n0h 1 11 1 . . 1 1 10 10 MET H H . . . 1 1 10 10 MET HB3 H . . . . . . . 3.95 . . . . . A . 10 MET H . . A . 10 MET HB3 . . . 10 MET H . . . . . 10 MET HB3 . . c25525_2n0h 1 12 1 . . 1 1 10 10 MET H H . . . 1 1 10 10 MET HB2 H . . . . . . . 3.95 . . . . . A . 10 MET H . . A . 10 MET HB2 . . . 10 MET H . . . . . 10 MET HB2 . . c25525_2n0h 1 13 1 . . 1 1 10 10 MET H H . . . 1 1 10 10 MET HG3 H . . . . . . . 3.92 . . . . . A . 10 MET H . . A . 10 MET HG3 . . . 10 MET H . . . . . 10 MET HG3 . . c25525_2n0h 1 14 1 . . 1 1 10 10 MET H H . . . 1 1 10 10 MET HG2 H . . . . . . . 3.92 . . . . . A . 10 MET H . . A . 10 MET HG2 . . . 10 MET H . . . . . 10 MET HG2 . . c25525_2n0h 1 15 1 . . 1 1 6 6 VAL H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 3.89 . . . . . A . 6 VAL H . . A . 6 VAL MG2 . . . 6 VAL H . . . . . 6 VAL QG2 . . c25525_2n0h 1 16 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU MD1 H . . . . . . . 4.20 . . . . . A . 9 LEU H . . A . 9 LEU MD1 . . . 9 LEU H . . . . . 9 LEU QD1 . . c25525_2n0h 1 17 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU HG H . . . . . . . 3.44 . . . . . A . 9 LEU H . . A . 9 LEU HG . . . 9 LEU H . . . . . 9 LEU HG . . c25525_2n0h 1 18 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HB2 H . . . . . . . 3.50 . . . . . A . 4 TRP H . . A . 4 TRP HB2 . . . 4 TRP H . . . . . 4 TRP HB2 . . c25525_2n0h 1 19 1 . . 1 1 2 2 ASN H H . . . 1 1 1 1 GLY HA2 H . . . . . . . 3.32 . . . . . A . 2 ASN H . . A . 1 GLY HA2 . . . 2 ASN H . . . . . 1 GLY HA2 . . c25525_2n0h 1 20 1 . . 1 1 2 2 ASN H H . . . 1 1 1 1 GLY HA3 H . . . . . . . 3.32 . . . . . A . 2 ASN H . . A . 1 GLY HA3 . . . 2 ASN H . . . . . 1 GLY HA3 . . c25525_2n0h 1 21 1 . . 1 1 5 5 ALA H H . . . 1 1 5 5 ALA MB H . . . . . . . 3.32 . . . . . A . 5 ALA H . . A . 5 ALA MB . . . 5 ALA H . . . . . 5 ALA QB . . c25525_2n0h 1 22 1 . . 1 1 9 9 LEU HG H . . . 1 1 9 9 LEU HA H . . . . . . . 3.50 . . . . . A . 9 LEU HG . . A . 9 LEU HA . . . 9 LEU HG . . . . . 9 LEU HA . . c25525_2n0h 1 23 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 6 6 VAL HA H . . . . . . . 3.25 . . . . . A . 6 VAL MG1 . . A . 6 VAL HA . . . 6 VAL QG1 . . . . . 6 VAL HA . . c25525_2n0h 1 24 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 6 6 VAL HA H . . . . . . . 3.27 . . . . . A . 6 VAL MG2 . . A . 6 VAL HA . . . 6 VAL QG2 . . . . . 6 VAL HA . . c25525_2n0h 1 25 1 . . 1 1 9 9 LEU HB3 H . . . 1 1 9 9 LEU MD1 H . . . . . . . 3.60 . . . . . A . 9 LEU HB3 . . A . 9 LEU MD1 . . . 9 LEU HB3 . . . . . 9 LEU QD1 . . c25525_2n0h 1 26 1 . . 1 1 9 9 LEU HB3 H . . . 1 1 9 9 LEU MD2 H . . . . . . . 3.45 . . . . . A . 9 LEU HB3 . . A . 9 LEU MD2 . . . 9 LEU HB3 . . . . . 9 LEU QD2 . . c25525_2n0h 1 27 1 . . 1 1 9 9 LEU HB2 H . . . 1 1 9 9 LEU MD2 H . . . . . . . 3.75 . . . . . A . 9 LEU HB2 . . A . 9 LEU MD2 . . . 9 LEU HB2 . . . . . 9 LEU QD2 . . c25525_2n0h 1 28 1 . . 1 1 9 9 LEU HA H . . . 1 1 9 9 LEU MD2 H . . . . . . . 2.95 . . . . . A . 9 LEU HA . . A . 9 LEU MD2 . . . 9 LEU HA . . . . . 9 LEU QD2 . . c25525_2n0h 1 29 1 . . 1 1 9 9 LEU MD1 H . . . 1 1 9 9 LEU HA H . . . . . . . 4.01 . . . . . A . 9 LEU MD1 . . A . 9 LEU HA . . . 9 LEU QD1 . . . . . 9 LEU HA . . c25525_2n0h 1 30 1 OR . 1 1 3 3 HIS HD2 H . . . 1 1 3 3 HIS HB2 H . . . . . . . 3.33 . . . . . A . 3 HIS HD2 . . A . 3 HIS HB2 . . . 3 HIS HD2 . . . . . 3 HIS QB . . c25525_2n0h 1 30 2 OR . 1 1 3 3 HIS HB3 H . . . 1 1 3 3 HIS HD2 H . . . . . . . 3.33 . . . . . A . 3 HIS HB3 . . A . 3 HIS HD2 . . . 3 HIS QB . . . . . 3 HIS HD2 . . c25525_2n0h 1 31 1 . . 1 1 9 9 LEU HB2 H . . . 1 1 9 9 LEU MD1 H . . . . . . . 3.53 . . . . . A . 9 LEU HB2 . . A . 9 LEU MD1 . . . 9 LEU HB2 . . . . . 9 LEU QD1 . . c25525_2n0h 1 32 1 . . 1 1 8 8 HIS H H . . . 1 1 7 7 GLY H H . . . . . . . 3.56 . . . . . A . 8 HIS H . . A . 7 GLY H . . . 8 HIS H . . . . . 7 GLY H . . c25525_2n0h 1 33 1 . . 1 1 6 6 VAL H H . . . 1 1 7 7 GLY H H . . . . . . . 3.50 . . . . . A . 6 VAL H . . A . 7 GLY H . . . 6 VAL H . . . . . 7 GLY H . . c25525_2n0h 1 34 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS H H . . . . . . . 3.43 . . . . . A . 9 LEU H . . A . 8 HIS H . . . 9 LEU H . . . . . 8 HIS H . . c25525_2n0h 1 35 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS H H . . . . . . . 3.70 . . . . . A . 4 TRP H . . A . 3 HIS H . . . 4 TRP H . . . . . 3 HIS H . . c25525_2n0h 1 36 1 . . 1 1 4 4 TRP H H . . . 1 1 5 5 ALA H H . . . . . . . 4.08 . . . . . A . 4 TRP H . . A . 5 ALA H . . . 4 TRP H . . . . . 5 ALA H . . c25525_2n0h 1 37 1 . . 1 1 9 9 LEU H H . . . 1 1 10 10 MET H H . . . . . . . 3.27 . . . . . A . 9 LEU H . . A . 10 MET H . . . 9 LEU H . . . . . 10 MET H . . c25525_2n0h 1 38 1 . . 1 1 9 9 LEU H H . . . 1 1 7 7 GLY H H . . . . . . . 4.52 . . . . . A . 9 LEU H . . A . 7 GLY H . . . 9 LEU H . . . . . 7 GLY H . . c25525_2n0h 1 39 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA H H . . . . . . . 3.69 . . . . . A . 6 VAL H . . A . 5 ALA H . . . 6 VAL H . . . . . 5 ALA H . . c25525_2n0h 1 40 1 . . 1 1 8 8 HIS H H . . . 1 1 10 10 MET H H . . . . . . . 4.24 . . . . . A . 8 HIS H . . A . 10 MET H . . . 8 HIS H . . . . . 10 MET H . . c25525_2n0h 1 41 1 . . 1 1 6 6 VAL HB H . . . 1 1 7 7 GLY H H . . . . . . . 4.18 . . . . . A . 6 VAL HB . . A . 7 GLY H . . . 6 VAL HB . . . . . 7 GLY H . . c25525_2n0h 1 42 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY H H . . . . . . . 4.14 . . . . . A . 6 VAL MG2 . . A . 7 GLY H . . . 6 VAL QG2 . . . . . 7 GLY H . . c25525_2n0h 1 43 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 GLY H H . . . . . . . 4.57 . . . . . A . 6 VAL MG1 . . A . 7 GLY H . . . 6 VAL QG1 . . . . . 7 GLY H . . c25525_2n0h 1 44 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HA H . . . . . . . 3.54 . . . . . A . 4 TRP H . . A . 3 HIS HA . . . 4 TRP H . . . . . 3 HIS HA . . c25525_2n0h 1 45 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.31 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS HB2 . . c25525_2n0h 1 46 1 . . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.31 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS HB3 . . c25525_2n0h 1 47 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA HA H . . . . . . . 3.50 . . . . . A . 6 VAL H . . A . 5 ALA HA . . . 6 VAL H . . . . . 5 ALA HA . . c25525_2n0h 1 48 1 . . 1 1 6 6 VAL H H . . . 1 1 5 5 ALA MB H . . . . . . . 3.65 . . . . . A . 6 VAL H . . A . 5 ALA MB . . . 6 VAL H . . . . . 5 ALA QB . . c25525_2n0h 1 49 1 . . 1 1 8 8 HIS H H . . . 1 1 6 6 VAL HA H . . . . . . . 4.30 . . . . . A . 8 HIS H . . A . 6 VAL HA . . . 8 HIS H . . . . . 6 VAL HA . . c25525_2n0h 1 50 1 . . 1 1 8 8 HIS H H . . . 1 1 5 5 ALA HA H . . . . . . . 4.44 . . . . . A . 8 HIS H . . A . 5 ALA HA . . . 8 HIS H . . . . . 5 ALA HA . . c25525_2n0h 1 51 1 . . 1 1 9 9 LEU HB2 H . . . 1 1 10 10 MET H H . . . . . . . 3.71 . . . . . A . 9 LEU HB2 . . A . 10 MET H . . . 9 LEU HB2 . . . . . 10 MET H . . c25525_2n0h 1 52 1 . . 1 1 9 9 LEU HB3 H . . . 1 1 10 10 MET H H . . . . . . . 4.12 . . . . . A . 9 LEU HB3 . . A . 10 MET H . . . 9 LEU HB3 . . . . . 10 MET H . . c25525_2n0h 1 53 1 . . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HB2 H . . . . . . . 4.72 . . . . . A . 3 HIS H . . A . 2 ASN HB2 . . . 3 HIS H . . . . . 2 ASN HB2 . . c25525_2n0h 1 54 1 . . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HB3 H . . . . . . . 4.72 . . . . . A . 3 HIS H . . A . 2 ASN HB3 . . . 3 HIS H . . . . . 2 ASN HB3 . . c25525_2n0h 1 55 1 OR . 1 1 6 6 VAL H H . . . 1 1 3 3 HIS HB2 H . . . . . . . 4.36 . . . . . A . 6 VAL H . . A . 3 HIS HB2 . . . 6 VAL H . . . . . 3 HIS QB . . c25525_2n0h 1 55 2 OR . 1 1 6 6 VAL H H . . . 1 1 3 3 HIS HB3 H . . . . . . . 4.36 . . . . . A . 6 VAL H . . A . 3 HIS HB3 . . . 6 VAL H . . . . . 3 HIS QB . . c25525_2n0h 1 56 1 OR . 1 1 6 6 VAL HB H . . . 1 1 3 3 HIS HB2 H . . . . . . . 4.14 . . . . . A . 6 VAL HB . . A . 3 HIS HB2 . . . 6 VAL HB . . . . . 3 HIS QB . . c25525_2n0h 1 56 2 OR . 1 1 6 6 VAL HB H . . . 1 1 3 3 HIS HB3 H . . . . . . . 4.14 . . . . . A . 6 VAL HB . . A . 3 HIS HB3 . . . 6 VAL HB . . . . . 3 HIS QB . . c25525_2n0h 1 57 1 OR . 1 1 6 6 VAL MG2 H . . . 1 1 3 3 HIS HB2 H . . . . . . . 4.37 . . . . . A . 6 VAL MG2 . . A . 3 HIS HB2 . . . 6 VAL QG2 . . . . . 3 HIS QB . . c25525_2n0h 1 57 2 OR . 1 1 3 3 HIS HB3 H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.37 . . . . . A . 3 HIS HB3 . . A . 6 VAL MG2 . . . 3 HIS QB . . . . . 6 VAL QG2 . . c25525_2n0h 1 58 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 10 10 MET HG3 H . . . . . . . 4.66 . . . . . A . 6 VAL MG2 . . A . 10 MET HG3 . . . 6 VAL QG2 . . . . . 10 MET HG3 . . c25525_2n0h 1 59 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 10 10 MET HG2 H . . . . . . . 4.66 . . . . . A . 6 VAL MG2 . . A . 10 MET HG2 . . . 6 VAL QG2 . . . . . 10 MET HG2 . . c25525_2n0h 1 60 1 . . 1 1 9 9 LEU HB2 H . . . 1 1 6 6 VAL HA H . . . . . . . 4.62 . . . . . A . 9 LEU HB2 . . A . 6 VAL HA . . . 9 LEU HB2 . . . . . 6 VAL HA . . c25525_2n0h 1 61 1 . . 1 1 9 9 LEU HG H . . . 1 1 6 6 VAL HA H . . . . . . . 4.77 . . . . . A . 9 LEU HG . . A . 6 VAL HA . . . 9 LEU HG . . . . . 6 VAL HA . . c25525_2n0h 1 62 1 . . 1 1 5 5 ALA MB H . . . 1 1 6 6 VAL HA H . . . . . . . 4.69 . . . . . A . 5 ALA MB . . A . 6 VAL HA . . . 5 ALA QB . . . . . 6 VAL HA . . c25525_2n0h 1 63 1 . . 1 1 9 9 LEU HB2 H . . . 1 1 9 9 LEU HG H . . . . . . . 2.77 . . . . . A . 9 LEU HB2 . . A . 9 LEU HG . . . 9 LEU HB2 . . . . . 9 LEU HG . . c25525_2n0h 1 64 1 . . 1 1 5 5 ALA MB H . . . 1 1 4 4 TRP HA H . . . . . . . 5.18 . . . . . A . 5 ALA MB . . A . 4 TRP HA . . . 5 ALA QB . . . . . 4 TRP HA . . c25525_2n0h 1 65 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HA H . . . . . . . 5.09 . . . . . A . 5 ALA HA . . A . 4 TRP HA . . . 5 ALA HA . . . . . 4 TRP HA . . c25525_2n0h 1 66 1 OR . 1 1 6 6 VAL MG1 H . . . 1 1 3 3 HIS HB2 H . . . . . . . 3.94 . . . . . A . 6 VAL MG1 . . A . 3 HIS HB2 . . . 6 VAL QG1 . . . . . 3 HIS QB . . c25525_2n0h 1 66 2 OR . 1 1 6 6 VAL MG1 H . . . 1 1 3 3 HIS HB3 H . . . . . . . 3.94 . . . . . A . 6 VAL MG1 . . A . 3 HIS HB3 . . . 6 VAL QG1 . . . . . 3 HIS QB . . c25525_2n0h 1 67 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 5 5 ALA HA H . . . . . . . 4.94 . . . . . A . 6 VAL MG1 . . A . 5 ALA HA . . . 6 VAL QG1 . . . . . 5 ALA HA . . c25525_2n0h 1 68 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.78 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA3 . . . 6 VAL QG2 . . . . . 7 GLY HA3 . . c25525_2n0h 1 69 1 . . 1 1 9 9 LEU HA H . . . 1 1 8 8 HIS HA H . . . . . . . 5.09 . . . . . A . 9 LEU HA . . A . 8 HIS HA . . . 9 LEU HA . . . . . 8 HIS HA . . c25525_2n0h 1 70 1 . . 1 1 9 9 LEU HA H . . . 1 1 10 10 MET HA H . . . . . . . 5.46 . . . . . A . 9 LEU HA . . A . 10 MET HA . . . 9 LEU HA . . . . . 10 MET HA . . c25525_2n0h 1 71 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 5 5 ALA H H . . . . . . . 4.31 . . . . . A . 4 TRP HB3 . . A . 5 ALA H . . . 4 TRP HB3 . . . . . 5 ALA H . . c25525_2n0h 1 72 1 . . 1 1 4 4 TRP HB2 H . . . 1 1 5 5 ALA H H . . . . . . . 4.39 . . . . . A . 4 TRP HB2 . . A . 5 ALA H . . . 4 TRP HB2 . . . . . 5 ALA H . . c25525_2n0h 1 73 1 . . 1 1 3 3 HIS HD2 H . . . 1 1 3 3 HIS HA H . . . . . . . 4.07 . . . . . A . 3 HIS HD2 . . A . 3 HIS HA . . . 3 HIS HD2 . . . . . 3 HIS HA . . c25525_2n0h 1 74 1 . . 1 1 4 4 TRP HA H . . . 1 1 4 4 TRP HD1 H . . . . . . . 3.70 . . . . . A . 4 TRP HA . . A . 4 TRP HD1 . . . 4 TRP HA . . . . . 4 TRP HD1 . . c25525_2n0h 1 75 1 . . 1 1 6 6 VAL HA H . . . 1 1 3 3 HIS HD2 H . . . . . . . 4.38 . . . . . A . 6 VAL HA . . A . 3 HIS HD2 . . . 6 VAL HA . . . . . 3 HIS HD2 . . c25525_2n0h 1 76 1 . . 1 1 4 4 TRP HA H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.38 . . . . . A . 4 TRP HA . . A . 4 TRP HE3 . . . 4 TRP HA . . . . . 4 TRP HE3 . . c25525_2n0h 1 77 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HE3 H . . . . . . . 3.66 . . . . . A . 5 ALA HA . . A . 4 TRP HE3 . . . 5 ALA HA . . . . . 4 TRP HE3 . . c25525_2n0h 1 78 1 . . 1 1 5 5 ALA MB H . . . 1 1 4 4 TRP HE3 H . . . . . . . 3.76 . . . . . A . 5 ALA MB . . A . 4 TRP HE3 . . . 5 ALA QB . . . . . 4 TRP HE3 . . c25525_2n0h 1 79 1 . . 1 1 8 8 HIS HA H . . . 1 1 8 8 HIS HD2 H . . . . . . . 4.88 . . . . . A . 8 HIS HA . . A . 8 HIS HD2 . . . 8 HIS HA . . . . . 8 HIS HD2 . . c25525_2n0h 1 80 1 . . 1 1 9 9 LEU MD2 H . . . 1 1 8 8 HIS HD2 H . . . . . . . 4.18 . . . . . A . 9 LEU MD2 . . A . 8 HIS HD2 . . . 9 LEU QD2 . . . . . 8 HIS HD2 . . c25525_2n0h 1 81 1 . . 1 1 10 10 MET H H . . . 1 1 9 9 LEU HG H . . . . . . . 4.11 . . . . . A . 10 MET H . . A . 9 LEU HG . . . 10 MET H . . . . . 9 LEU HG . . c25525_2n0h 1 82 1 . . 1 1 5 5 ALA H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.22 . . . . . A . 5 ALA H . . A . 4 TRP HE3 . . . 5 ALA H . . . . . 4 TRP HE3 . . c25525_2n0h 1 83 1 . . 1 1 4 4 TRP H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.64 . . . . . A . 4 TRP H . . A . 4 TRP HE3 . . . 4 TRP H . . . . . 4 TRP HE3 . . c25525_2n0h 1 84 1 . . 1 1 4 4 TRP H H . . . 1 1 3 3 HIS HD2 H . . . . . . . 4.51 . . . . . A . 4 TRP H . . A . 3 HIS HD2 . . . 4 TRP H . . . . . 3 HIS HD2 . . c25525_2n0h 1 85 1 . . 1 1 6 6 VAL H H . . . 1 1 3 3 HIS HD2 H . . . . . . . 4.64 . . . . . A . 6 VAL H . . A . 3 HIS HD2 . . . 6 VAL H . . . . . 3 HIS HD2 . . c25525_2n0h 1 86 1 . . 1 1 6 6 VAL H H . . . 1 1 4 4 TRP HE3 H . . . . . . . 4.99 . . . . . A . 6 VAL H . . A . 4 TRP HE3 . . . 6 VAL H . . . . . 4 TRP HE3 . . c25525_2n0h 1 87 1 . . 1 1 9 9 LEU H H . . . 1 1 9 9 LEU MD2 H . . . . . . . 4.38 . . . . . A . 9 LEU H . . A . 9 LEU MD2 . . . 9 LEU H . . . . . 9 LEU QD2 . . c25525_2n0h 1 88 1 . . 1 1 10 10 MET H H . . . 1 1 6 6 VAL MG2 H . . . . . . . 4.28 . . . . . A . 10 MET H . . A . 6 VAL MG2 . . . 10 MET H . . . . . 6 VAL QG2 . . c25525_2n0h 1 89 1 . . 1 1 10 10 MET H H . . . 1 1 9 9 LEU MD1 H . . . . . . . 4.72 . . . . . A . 10 MET H . . A . 9 LEU MD1 . . . 10 MET H . . . . . 9 LEU QD1 . . c25525_2n0h 1 90 1 . . 1 1 10 10 MET H H . . . 1 1 9 9 LEU MD2 H . . . . . . . 4.59 . . . . . A . 10 MET H . . A . 9 LEU MD2 . . . 10 MET H . . . . . 9 LEU QD2 . . c25525_2n0h 1 91 1 . . 1 1 6 6 VAL MG1 H . . . 1 1 3 3 HIS HD2 H . . . . . . . 4.35 . . . . . A . 6 VAL MG1 . . A . 3 HIS HD2 . . . 6 VAL QG1 . . . . . 3 HIS HD2 . . c25525_2n0h 1 92 1 . . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HD2 H . . . . . . . 5.06 . . . . . A . 8 HIS H . . A . 8 HIS HD2 . . . 8 HIS H . . . . . 8 HIS HD2 . . c25525_2n0h 1 93 1 . . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HA H . . . . . . . 3.54 . . . . . A . 3 HIS H . . A . 2 ASN HA . . . 3 HIS H . . . . . 2 ASN HA . . c25525_2n0h 1 94 1 . . 1 1 3 3 HIS H H . . . 1 1 1 1 GLY HA2 H . . . . . . . 5.17 . . . . . A . 3 HIS H . . A . 1 GLY HA2 . . . 3 HIS H . . . . . 1 GLY HA2 . . c25525_2n0h 1 95 1 . . 1 1 3 3 HIS H H . . . 1 1 1 1 GLY HA3 H . . . . . . . 5.17 . . . . . A . 3 HIS H . . A . 1 GLY HA3 . . . 3 HIS H . . . . . 1 GLY HA3 . . c25525_2n0h 1 96 1 . . 1 1 7 7 GLY H H . . . 1 1 5 5 ALA HA H . . . . . . . 4.94 . . . . . A . 7 GLY H . . A . 5 ALA HA . . . 7 GLY H . . . . . 5 ALA HA . . c25525_2n0h 1 97 1 . . 1 1 7 7 GLY H H . . . 1 1 4 4 TRP HA H . . . . . . . 5.33 . . . . . A . 7 GLY H . . A . 4 TRP HA . . . 7 GLY H . . . . . 4 TRP HA . . c25525_2n0h 1 98 1 OR . 1 1 7 7 GLY H H . . . 1 1 3 3 HIS HB2 H . . . . . . . 5.50 . . . . . A . 7 GLY H . . A . 3 HIS HB2 . . . 7 GLY H . . . . . 3 HIS QB . . c25525_2n0h 1 98 2 OR . 1 1 3 3 HIS HB3 H . . . 1 1 7 7 GLY H H . . . . . . . 5.50 . . . . . A . 3 HIS HB3 . . A . 7 GLY H . . . 3 HIS QB . . . . . 7 GLY H . . c25525_2n0h 1 99 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 7 7 GLY H H . . . . . . . 5.50 . . . . . A . 4 TRP HB3 . . A . 7 GLY H . . . 4 TRP HB3 . . . . . 7 GLY H . . c25525_2n0h 1 100 1 . . 1 1 4 4 TRP H H . . . 1 1 5 5 ALA MB H . . . . . . . 5.24 . . . . . A . 4 TRP H . . A . 5 ALA MB . . . 4 TRP H . . . . . 5 ALA QB . . c25525_2n0h 1 101 1 . . 1 1 9 9 LEU H H . . . 1 1 7 7 GLY HA3 H . . . . . . . 5.31 . . . . . A . 9 LEU H . . A . 7 GLY HA3 . . . 9 LEU H . . . . . 7 GLY HA3 . . c25525_2n0h 1 102 1 . . 1 1 9 9 LEU H H . . . 1 1 7 7 GLY HA2 H . . . . . . . 5.31 . . . . . A . 9 LEU H . . A . 7 GLY HA2 . . . 9 LEU H . . . . . 7 GLY HA2 . . c25525_2n0h 1 103 1 . . 1 1 9 9 LEU H H . . . 1 1 6 6 VAL HA H . . . . . . . 4.56 . . . . . A . 9 LEU H . . A . 6 VAL HA . . . 9 LEU H . . . . . 6 VAL HA . . c25525_2n0h 1 104 1 . . 1 1 10 10 MET H H . . . 1 1 6 6 VAL HA H . . . . . . . 5.08 . . . . . A . 10 MET H . . A . 6 VAL HA . . . 10 MET H . . . . . 6 VAL HA . . c25525_2n0h 1 105 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 4 4 TRP HE3 H . . . . . . . 3.54 . . . . . A . 4 TRP HB3 . . A . 4 TRP HE3 . . . 4 TRP HB3 . . . . . 4 TRP HE3 . . c25525_2n0h 1 106 1 . . 1 1 9 9 LEU HA H . . . 1 1 8 8 HIS HD2 H . . . . . . . 5.24 . . . . . A . 9 LEU HA . . A . 8 HIS HD2 . . . 9 LEU HA . . . . . 8 HIS HD2 . . c25525_2n0h 1 107 1 . . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HD2 H . . . . . . . 5.50 . . . . . A . 5 ALA HA . . A . 8 HIS HD2 . . . 5 ALA HA . . . . . 8 HIS HD2 . . c25525_2n0h 1 108 1 . . 1 1 9 9 LEU HG H . . . 1 1 8 8 HIS HD2 H . . . . . . . 5.08 . . . . . A . 9 LEU HG . . A . 8 HIS HD2 . . . 9 LEU HG . . . . . 8 HIS HD2 . . c25525_2n0h 1 109 1 . . 1 1 5 5 ALA HA H . . . 1 1 4 4 TRP HZ3 H . . . . . . . 4.81 . . . . . A . 5 ALA HA . . A . 4 TRP HZ3 . . . 5 ALA HA . . . . . 4 TRP HZ3 . . c25525_2n0h 1 110 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 4 4 TRP HZ3 H . . . . . . . 5.35 . . . . . A . 4 TRP HB3 . . A . 4 TRP HZ3 . . . 4 TRP HB3 . . . . . 4 TRP HZ3 . . c25525_2n0h 1 111 1 . . 1 1 5 5 ALA MB H . . . 1 1 4 4 TRP HZ3 H . . . . . . . 4.74 . . . . . A . 5 ALA MB . . A . 4 TRP HZ3 . . . 5 ALA QB . . . . . 4 TRP HZ3 . . c25525_2n0h 1 112 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 10 10 MET HA H . . . . . . . 5.41 . . . . . A . 6 VAL MG2 . . A . 10 MET HA . . . 6 VAL QG2 . . . . . 10 MET HA . . c25525_2n0h 1 113 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 5 5 ALA HA H . . . . . . . 5.16 . . . . . A . 4 TRP HB3 . . A . 5 ALA HA . . . 4 TRP HB3 . . . . . 5 ALA HA . . c25525_2n0h 1 114 1 . . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HB2 H . . . . . . . 5.02 . . . . . A . 5 ALA HA . . A . 8 HIS HB2 . . . 5 ALA HA . . . . . 8 HIS HB2 . . c25525_2n0h 1 115 1 . . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HB3 H . . . . . . . 5.02 . . . . . A . 5 ALA HA . . A . 8 HIS HB3 . . . 5 ALA HA . . . . . 8 HIS HB3 . . c25525_2n0h 1 116 1 . . 1 1 9 9 LEU MD1 H . . . 1 1 5 5 ALA HA H . . . . . . . 5.28 . . . . . A . 9 LEU MD1 . . A . 5 ALA HA . . . 9 LEU QD1 . . . . . 5 ALA HA . . c25525_2n0h 1 117 1 . . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.78 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA2 . . . 6 VAL QG2 . . . . . 7 GLY HA2 . . c25525_2n0h 1 118 1 . . 1 1 9 9 LEU HG H . . . 1 1 8 8 HIS HA H . . . . . . . 5.11 . . . . . A . 9 LEU HG . . A . 8 HIS HA . . . 9 LEU HG . . . . . 8 HIS HA . . c25525_2n0h 1 119 1 . . 1 1 4 4 TRP HB3 H . . . 1 1 5 5 ALA MB H . . . . . . . 4.74 . . . . . A . 4 TRP HB3 . . A . 5 ALA MB . . . 4 TRP HB3 . . . . . 5 ALA QB . . c25525_2n0h 1 120 1 . . 1 1 5 5 ALA MB H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.87 . . . . . A . 5 ALA MB . . A . 8 HIS HB2 . . . 5 ALA QB . . . . . 8 HIS HB2 . . c25525_2n0h 1 121 1 . . 1 1 5 5 ALA MB H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.87 . . . . . A . 5 ALA MB . . A . 8 HIS HB3 . . . 5 ALA QB . . . . . 8 HIS HB3 . . c25525_2n0h 1 122 1 OR . 1 1 3 3 HIS H H . . . 1 1 1 1 GLY HA3 H . . . . . . . 4.43 . . . . . A . 3 HIS H . . A . 1 GLY HA3 . . . 3 HIS H . . . . . 1 GLY QA . . c25525_2n0h 1 122 2 OR . 1 1 3 3 HIS H H . . . 1 1 1 1 GLY HA2 H . . . . . . . 4.43 . . . . . A . 3 HIS H . . A . 1 GLY HA2 . . . 3 HIS H . . . . . 1 GLY QA . . c25525_2n0h 1 123 1 OR . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB3 H . . . . . . . 3.23 . . . . . A . 2 ASN H . . A . 2 ASN HB3 . . . 2 ASN H . . . . . 2 ASN QB . . c25525_2n0h 1 123 2 OR . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HB2 H . . . . . . . 3.23 . . . . . A . 2 ASN H . . A . 2 ASN HB2 . . . 2 ASN H . . . . . 2 ASN QB . . c25525_2n0h 1 124 1 OR . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HD22 H . . . . . . . 4.57 . . . . . A . 2 ASN H . . A . 2 ASN HD22 . . . 2 ASN H . . . . . 2 ASN QD2 . . c25525_2n0h 1 124 2 OR . 1 1 2 2 ASN H H . . . 1 1 2 2 ASN HD21 H . . . . . . . 4.57 . . . . . A . 2 ASN H . . A . 2 ASN HD21 . . . 2 ASN H . . . . . 2 ASN QD2 . . c25525_2n0h 1 125 1 OR . 1 1 2 2 ASN HB3 H . . . 1 1 2 2 ASN HD22 H . . . . . . . 3.07 . . . . . A . 2 ASN HB3 . . A . 2 ASN HD22 . . . 2 ASN QB . . . . . 2 ASN QD2 . . c25525_2n0h 1 125 2 OR . 1 1 2 2 ASN HB2 H . . . 1 1 2 2 ASN HD22 H . . . . . . . 3.07 . . . . . A . 2 ASN HB2 . . A . 2 ASN HD22 . . . 2 ASN QB . . . . . 2 ASN QD2 . . c25525_2n0h 1 125 3 OR . 1 1 2 2 ASN HD21 H . . . 1 1 2 2 ASN HB3 H . . . . . . . 3.07 . . . . . A . 2 ASN HD21 . . A . 2 ASN HB3 . . . 2 ASN QD2 . . . . . 2 ASN QB . . c25525_2n0h 1 125 4 OR . 1 1 2 2 ASN HB2 H . . . 1 1 2 2 ASN HD21 H . . . . . . . 3.07 . . . . . A . 2 ASN HB2 . . A . 2 ASN HD21 . . . 2 ASN QB . . . . . 2 ASN QD2 . . c25525_2n0h 1 126 1 OR . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HB3 H . . . . . . . 4.12 . . . . . A . 3 HIS H . . A . 2 ASN HB3 . . . 3 HIS H . . . . . 2 ASN QB . . c25525_2n0h 1 126 2 OR . 1 1 3 3 HIS H H . . . 1 1 2 2 ASN HB2 H . . . . . . . 4.12 . . . . . A . 3 HIS H . . A . 2 ASN HB2 . . . 3 HIS H . . . . . 2 ASN QB . . c25525_2n0h 1 127 1 OR . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.42 . . . . . A . 5 ALA HA . . A . 8 HIS HB3 . . . 5 ALA HA . . . . . 8 HIS QB . . c25525_2n0h 1 127 2 OR . 1 1 5 5 ALA HA H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.42 . . . . . A . 5 ALA HA . . A . 8 HIS HB2 . . . 5 ALA HA . . . . . 8 HIS QB . . c25525_2n0h 1 128 1 OR . 1 1 5 5 ALA MB H . . . 1 1 8 8 HIS HB3 H . . . . . . . 4.16 . . . . . A . 5 ALA MB . . A . 8 HIS HB3 . . . 5 ALA QB . . . . . 8 HIS QB . . c25525_2n0h 1 128 2 OR . 1 1 5 5 ALA MB H . . . 1 1 8 8 HIS HB2 H . . . . . . . 4.16 . . . . . A . 5 ALA MB . . A . 8 HIS HB2 . . . 5 ALA QB . . . . . 8 HIS QB . . c25525_2n0h 1 129 1 OR . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.69 . . . . . A . 6 VAL MG1 . . A . 7 GLY HA3 . . . 6 VAL QG1 . . . . . 7 GLY QA . . c25525_2n0h 1 129 2 OR . 1 1 6 6 VAL MG1 H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.69 . . . . . A . 6 VAL MG1 . . A . 7 GLY HA2 . . . 6 VAL QG1 . . . . . 7 GLY QA . . c25525_2n0h 1 130 1 OR . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.08 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA3 . . . 6 VAL QG2 . . . . . 7 GLY QA . . c25525_2n0h 1 130 2 OR . 1 1 6 6 VAL MG2 H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.08 . . . . . A . 6 VAL MG2 . . A . 7 GLY HA2 . . . 6 VAL QG2 . . . . . 7 GLY QA . . c25525_2n0h 1 131 1 OR . 1 1 9 9 LEU H H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.63 . . . . . A . 9 LEU H . . A . 7 GLY HA3 . . . 9 LEU H . . . . . 7 GLY QA . . c25525_2n0h 1 131 2 OR . 1 1 9 9 LEU H H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.63 . . . . . A . 9 LEU H . . A . 7 GLY HA2 . . . 9 LEU H . . . . . 7 GLY QA . . c25525_2n0h 1 132 1 OR . 1 1 10 10 MET H H . . . 1 1 7 7 GLY HA3 H . . . . . . . 4.68 . . . . . A . 10 MET H . . A . 7 GLY HA3 . . . 10 MET H . . . . . 7 GLY QA . . c25525_2n0h 1 132 2 OR . 1 1 10 10 MET H H . . . 1 1 7 7 GLY HA2 H . . . . . . . 4.68 . . . . . A . 10 MET H . . A . 7 GLY HA2 . . . 10 MET H . . . . . 7 GLY QA . . c25525_2n0h 1 133 1 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.17 . . . . . A . 8 HIS H . . A . 8 HIS HB3 . . . 8 HIS H . . . . . 8 HIS QB . . c25525_2n0h 1 133 2 OR . 1 1 8 8 HIS H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.17 . . . . . A . 8 HIS H . . A . 8 HIS HB2 . . . 8 HIS H . . . . . 8 HIS QB . . c25525_2n0h 1 134 1 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB3 H . . . . . . . 3.77 . . . . . A . 9 LEU H . . A . 8 HIS HB3 . . . 9 LEU H . . . . . 8 HIS QB . . c25525_2n0h 1 134 2 OR . 1 1 9 9 LEU H H . . . 1 1 8 8 HIS HB2 H . . . . . . . 3.77 . . . . . A . 9 LEU H . . A . 8 HIS HB2 . . . 9 LEU H . . . . . 8 HIS QB . . c25525_2n0h 1 135 1 OR . 1 1 9 9 LEU HG H . . . 1 1 8 8 HIS HB3 H . . . . . . . 5.21 . . . . . A . 9 LEU HG . . A . 8 HIS HB3 . . . 9 LEU HG . . . . . 8 HIS QB . . c25525_2n0h 1 135 2 OR . 1 1 9 9 LEU HG H . . . 1 1 8 8 HIS HB2 H . . . . . . . 5.21 . . . . . A . 9 LEU HG . . A . 8 HIS HB2 . . . 9 LEU HG . . . . . 8 HIS QB . . c25525_2n0h 1 136 1 OR . 1 1 9 9 LEU MD1 H . . . 1 1 10 10 MET HG3 H . . . . . . . 5.21 . . . . . A . 9 LEU MD1 . . A . 10 MET HG3 . . . 9 LEU QD1 . . . . . 10 MET QG . . c25525_2n0h 1 136 2 OR . 1 1 9 9 LEU MD1 H . . . 1 1 10 10 MET HG2 H . . . . . . . 5.21 . . . . . A . 9 LEU MD1 . . A . 10 MET HG2 . . . 9 LEU QD1 . . . . . 10 MET QG . . c25525_2n0h 1 137 1 OR . 1 1 10 10 MET H H . . . 1 1 10 10 MET HB3 H . . . . . . . 3.20 . . . . . A . 10 MET H . . A . 10 MET HB3 . . . 10 MET H . . . . . 10 MET QB . . c25525_2n0h 1 137 2 OR . 1 1 10 10 MET H H . . . 1 1 10 10 MET HB2 H . . . . . . . 3.20 . . . . . A . 10 MET H . . A . 10 MET HB2 . . . 10 MET H . . . . . 10 MET QB . . c25525_2n0h 1 138 1 OR . 1 1 10 10 MET HA H . . . 1 1 10 10 MET HG3 H . . . . . . . 3.71 . . . . . A . 10 MET HA . . A . 10 MET HG3 . . . 10 MET HA . . . . . 10 MET QG . . c25525_2n0h 1 138 2 OR . 1 1 10 10 MET HA H . . . 1 1 10 10 MET HG2 H . . . . . . . 3.71 . . . . . A . 10 MET HA . . A . 10 MET HG2 . . . 10 MET HA . . . . . 10 MET QG . . c25525_2n0h 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_framecode MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID c25525_2n0h _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details 'Generated by Wattos' _Org_constr_file_comment.Comment '*HEADER HORMONE 05-MAR-15 2N0H *TITLE NMR STRUCTURE OF NEUROMEDIN C IN PRESENCE OF SDS MICELLES *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: GASTRIN-RELEASING PEPTIDE; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: UNP RESIDUES 41-50; *COMPND 5 SYNONYM: GRP, NEUROMEDIN-C, GRP-10; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 4 ORGANISM_COMMON: HUMAN; *SOURCE 5 ORGANISM_TAXID: 9606 *KEYWDS NEUROPEPTIDE, FEEDING REGULATION, HORMONE *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR M.ADROVER, P.SANCHIS, B.VILANOVA, K.PAUWELS, G.MARTORELL, J.PEREZ *REVDAT 1 14-OCT-15 2N0H 0' save_